BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 98 hits with Last Name = 'kelley' and Initial = 'jl'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50042365
PNG
(CHEMBL117417 | [3-(2-Amino-6-oxo-1,6-dihydro-purin...)
Show SMILES Nc1nc2n(Cc3cccc(CSCP(O)(O)=O)c3)cnc2c(=O)[nH]1
Show InChI InChI=1S/C14H16N5O4PS/c15-14-17-12-11(13(20)18-14)16-7-19(12)5-9-2-1-3-10(4-9)6-25-8-24(21,22)23/h1-4,7H,5-6,8H2,(H2,21,22,23)(H3,15,17,18,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
1.10n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of purine nucleoside phosphorylase of human erythrocytes in xanthine oxidase-coupled assay


J Med Chem 36: 3455-63 (1993)


Article DOI: 10.1021/jm00074a029
BindingDB Entry DOI: 10.7270/Q2PR7V1V
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50033660
PNG
(CHEMBL269745 | {[5-(2-Amino-6-oxo-1,6-dihydro-puri...)
Show SMILES Nc1nc2n(CCCCCP(O)(=O)CP(O)(O)=O)cnc2c(=O)[nH]1
Show InChI InChI=1S/C11H19N5O6P2/c12-11-14-9-8(10(17)15-11)13-6-16(9)4-2-1-3-5-23(18,19)7-24(20,21)22/h6H,1-5,7H2,(H,18,19)(H2,20,21,22)(H3,12,14,15,17)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
3.10n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte purine nucleoside phosphorylase (PNPase) in the presence of zinc chloride


J Med Chem 38: 1005-14 (1995)


Article DOI: 10.1021/jm00006a020
BindingDB Entry DOI: 10.7270/Q2FF3RDR
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50033663
PNG
(CHEMBL7319 | {[6-(2-Amino-6-oxo-1,6-dihydro-purin-...)
Show SMILES Nc1nc2n(CCCCCCP(O)(=O)CP(O)(O)=O)cnc2c(=O)[nH]1
Show InChI InChI=1S/C12H21N5O6P2/c13-12-15-10-9(11(18)16-12)14-7-17(10)5-3-1-2-4-6-24(19,20)8-25(21,22)23/h7H,1-6,8H2,(H,19,20)(H2,21,22,23)(H3,13,15,16,18)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
3.70n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte purine nucleoside phosphorylase (PNPase) in the presence of zinc chloride


J Med Chem 38: 1005-14 (1995)


Article DOI: 10.1021/jm00006a020
BindingDB Entry DOI: 10.7270/Q2FF3RDR
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50033666
PNG
(2-[(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)methox...)
Show SMILES Nc1nc2n(COCCOP(O)(=O)OP(O)(O)=O)cnc2c(=O)[nH]1
Show InChI InChI=1S/C8H13N5O9P2/c9-8-11-6-5(7(14)12-8)10-3-13(6)4-20-1-2-21-24(18,19)22-23(15,16)17/h3H,1-2,4H2,(H,18,19)(H2,15,16,17)(H3,9,11,12,14)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
KEGG
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
4.20n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte purine nucleoside phosphorylase (PNPase) in the presence of zinc chloride


J Med Chem 38: 1005-14 (1995)


Article DOI: 10.1021/jm00006a020
BindingDB Entry DOI: 10.7270/Q2FF3RDR
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50033666
PNG
(2-[(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)methox...)
Show SMILES Nc1nc2n(COCCOP(O)(=O)OP(O)(O)=O)cnc2c(=O)[nH]1
Show InChI InChI=1S/C8H13N5O9P2/c9-8-11-6-5(7(14)12-8)10-3-13(6)4-20-1-2-21-24(18,19)22-23(15,16)17/h3H,1-2,4H2,(H,18,19)(H2,15,16,17)(H3,9,11,12,14)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
KEGG
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
5.20n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of purine nucleoside phosphorylase of human erythrocytes in xanthine oxidase-coupled assay


J Med Chem 36: 3455-63 (1993)


Article DOI: 10.1021/jm00074a029
BindingDB Entry DOI: 10.7270/Q2PR7V1V
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50042370
PNG
(CHEMBL326595 | [3-(2-Amino-6-oxo-1,6-dihydro-purin...)
Show SMILES Nc1nc2n(Cc3cccc(COCP(O)(O)=O)c3)cnc2c(=O)[nH]1
Show InChI InChI=1S/C14H16N5O5P/c15-14-17-12-11(13(20)18-14)16-7-19(12)5-9-2-1-3-10(4-9)6-24-8-25(21,22)23/h1-4,7H,5-6,8H2,(H2,21,22,23)(H3,15,17,18,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
5.80n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of purine nucleoside phosphorylase of human erythrocytes in xanthine oxidase-coupled assay


J Med Chem 36: 3455-63 (1993)


Article DOI: 10.1021/jm00074a029
BindingDB Entry DOI: 10.7270/Q2PR7V1V
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50042364
PNG
(CHEMBL327010 | [2-(2-Amino-6-oxo-1,6-dihydro-purin...)
Show SMILES Nc1nc2n(Cc3ccccc3OCP(O)(O)=O)cnc2c(=O)[nH]1
Show InChI InChI=1S/C13H14N5O5P/c14-13-16-11-10(12(19)17-13)15-6-18(11)5-8-3-1-2-4-9(8)23-7-24(20,21)22/h1-4,6H,5,7H2,(H2,20,21,22)(H3,14,16,17,19)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
8.30n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of purine nucleoside phosphorylase of human erythrocytes in xanthine oxidase-coupled assay


J Med Chem 36: 3455-63 (1993)


Article DOI: 10.1021/jm00074a029
BindingDB Entry DOI: 10.7270/Q2PR7V1V
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50033661
PNG
(CHEMBL7247 | {[7-(2-Amino-6-oxo-1,6-dihydro-purin-...)
Show SMILES Nc1nc2n(CCCCCCCP(O)(=O)CP(O)(O)=O)cnc2c(=O)[nH]1
Show InChI InChI=1S/C13H23N5O6P2/c14-13-16-11-10(12(19)17-13)15-8-18(11)6-4-2-1-3-5-7-25(20,21)9-26(22,23)24/h8H,1-7,9H2,(H,20,21)(H2,22,23,24)(H3,14,16,17,19)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
10n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte purine nucleoside phosphorylase (PNPase) in the presence of zinc chloride


J Med Chem 38: 1005-14 (1995)


Article DOI: 10.1021/jm00006a020
BindingDB Entry DOI: 10.7270/Q2FF3RDR
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50033666
PNG
(2-[(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)methox...)
Show SMILES Nc1nc2n(COCCOP(O)(=O)OP(O)(O)=O)cnc2c(=O)[nH]1
Show InChI InChI=1S/C8H13N5O9P2/c9-8-11-6-5(7(14)12-8)10-3-13(6)4-20-1-2-21-24(18,19)22-23(15,16)17/h3H,1-2,4H2,(H,18,19)(H2,15,16,17)(H3,9,11,12,14)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
KEGG
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
11n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte purine nucleoside phosphorylase (PNPase) in the presence of ethylenediaminetetraacetic acid (Na2 EDTA)


J Med Chem 38: 1005-14 (1995)


Article DOI: 10.1021/jm00006a020
BindingDB Entry DOI: 10.7270/Q2FF3RDR
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50042372
PNG
(CHEMBL117127 | {3-[3-(2-Amino-6-oxo-1,6-dihydro-pu...)
Show SMILES Nc1nc2n(Cc3cccc(CCCP(O)(O)=O)c3)cnc2c(=O)[nH]1
Show InChI InChI=1S/C15H18N5O4P/c16-15-18-13-12(14(21)19-15)17-9-20(13)8-11-4-1-3-10(7-11)5-2-6-25(22,23)24/h1,3-4,7,9H,2,5-6,8H2,(H2,22,23,24)(H3,16,18,19,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
13n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of purine nucleoside phosphorylase of human erythrocytes in xanthine oxidase-coupled assay


J Med Chem 36: 3455-63 (1993)


Article DOI: 10.1021/jm00074a029
BindingDB Entry DOI: 10.7270/Q2PR7V1V
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50042363
PNG
(CHEMBL333946 | {2-[2-(2-Amino-6-oxo-1,6-dihydro-pu...)
Show SMILES Nc1nc2n(Cc3ccccc3CCP(O)(O)=O)cnc2c(=O)[nH]1
Show InChI InChI=1S/C14H16N5O4P/c15-14-17-12-11(13(20)18-14)16-8-19(12)7-10-4-2-1-3-9(10)5-6-24(21,22)23/h1-4,8H,5-7H2,(H2,21,22,23)(H3,15,17,18,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
35n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of purine nucleoside phosphorylase of human erythrocytes in xanthine oxidase-coupled assay


J Med Chem 36: 3455-63 (1993)


Article DOI: 10.1021/jm00074a029
BindingDB Entry DOI: 10.7270/Q2PR7V1V
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50042367
PNG
(CHEMBL325716 | {3-[3-(2-Amino-6-oxo-1,6-dihydro-pu...)
Show SMILES Nc1nc2n(Cc3cccc(C=CCP(O)(O)=O)c3)cnc2c(=O)[nH]1
Show InChI InChI=1S/C15H16N5O4P/c16-15-18-13-12(14(21)19-15)17-9-20(13)8-11-4-1-3-10(7-11)5-2-6-25(22,23)24/h1-5,7,9H,6,8H2,(H2,22,23,24)(H3,16,18,19,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
60n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of purine nucleoside phosphorylase of human erythrocytes in xanthine oxidase-coupled assay


J Med Chem 36: 3455-63 (1993)


Article DOI: 10.1021/jm00074a029
BindingDB Entry DOI: 10.7270/Q2PR7V1V
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50042369
PNG
(CHEMBL119243 | {2-[3-(2-Amino-6-oxo-1,6-dihydro-pu...)
Show SMILES Nc1nc2n(Cc3cccc(COCCP(O)(O)=O)c3)cnc2c(=O)[nH]1
Show InChI InChI=1S/C15H18N5O5P/c16-15-18-13-12(14(21)19-15)17-9-20(13)7-10-2-1-3-11(6-10)8-25-4-5-26(22,23)24/h1-3,6,9H,4-5,7-8H2,(H2,22,23,24)(H3,16,18,19,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
69n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of purine nucleoside phosphorylase of human erythrocytes in xanthine oxidase-coupled assay


J Med Chem 36: 3455-63 (1993)


Article DOI: 10.1021/jm00074a029
BindingDB Entry DOI: 10.7270/Q2PR7V1V
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50033664
PNG
(CHEMBL7068 | {[4-(2-Amino-6-oxo-1,6-dihydro-purin-...)
Show SMILES Nc1nc2n(CCCCP(O)(=O)CP(O)(O)=O)cnc2c(=O)[nH]1
Show InChI InChI=1S/C10H17N5O6P2/c11-10-13-8-7(9(16)14-10)12-5-15(8)3-1-2-4-22(17,18)6-23(19,20)21/h5H,1-4,6H2,(H,17,18)(H2,19,20,21)(H3,11,13,14,16)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
100n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte purine nucleoside phosphorylase (PNPase) in the presence of zinc chloride


J Med Chem 38: 1005-14 (1995)


Article DOI: 10.1021/jm00006a020
BindingDB Entry DOI: 10.7270/Q2FF3RDR
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50042362
PNG
(CHEMBL331133 | [2-(2-Amino-6-oxo-1,6-dihydro-purin...)
Show SMILES Nc1nc2n(Cc3ccccc3COCP(O)(O)=O)cnc2c(=O)[nH]1
Show InChI InChI=1S/C14H16N5O5P/c15-14-17-12-11(13(20)18-14)16-7-19(12)5-9-3-1-2-4-10(9)6-24-8-25(21,22)23/h1-4,7H,5-6,8H2,(H2,21,22,23)(H3,15,17,18,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
150n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of purine nucleoside phosphorylase of human erythrocytes in xanthine oxidase-coupled assay


J Med Chem 36: 3455-63 (1993)


Article DOI: 10.1021/jm00074a029
BindingDB Entry DOI: 10.7270/Q2PR7V1V
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50033663
PNG
(CHEMBL7319 | {[6-(2-Amino-6-oxo-1,6-dihydro-purin-...)
Show SMILES Nc1nc2n(CCCCCCP(O)(=O)CP(O)(O)=O)cnc2c(=O)[nH]1
Show InChI InChI=1S/C12H21N5O6P2/c13-12-15-10-9(11(18)16-12)14-7-17(10)5-3-1-2-4-6-24(19,20)8-25(21,22)23/h7H,1-6,8H2,(H,19,20)(H2,21,22,23)(H3,13,15,16,18)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
390n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte purine nucleoside phosphorylase (PNPase) in the presence of ethylenediaminetetraacetic acid (Na2 EDTA)


J Med Chem 38: 1005-14 (1995)


Article DOI: 10.1021/jm00006a020
BindingDB Entry DOI: 10.7270/Q2FF3RDR
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50042366
PNG
(CHEMBL116580 | [3-(2-Amino-6-oxo-1,6-dihydro-purin...)
Show SMILES Nc1nc2n(Cc3cccc(OCP(O)(O)=O)c3)cnc2c(=O)[nH]1
Show InChI InChI=1S/C13H14N5O5P/c14-13-16-11-10(12(19)17-13)15-6-18(11)5-8-2-1-3-9(4-8)23-7-24(20,21)22/h1-4,6H,5,7H2,(H2,20,21,22)(H3,14,16,17,19)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
600n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of purine nucleoside phosphorylase of human erythrocytes in xanthine oxidase-coupled assay


J Med Chem 36: 3455-63 (1993)


Article DOI: 10.1021/jm00074a029
BindingDB Entry DOI: 10.7270/Q2PR7V1V
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50033660
PNG
(CHEMBL269745 | {[5-(2-Amino-6-oxo-1,6-dihydro-puri...)
Show SMILES Nc1nc2n(CCCCCP(O)(=O)CP(O)(O)=O)cnc2c(=O)[nH]1
Show InChI InChI=1S/C11H19N5O6P2/c12-11-14-9-8(10(17)15-11)13-6-16(9)4-2-1-3-5-23(18,19)7-24(20,21)22/h6H,1-5,7H2,(H,18,19)(H2,20,21,22)(H3,12,14,15,17)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
900n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte purine nucleoside phosphorylase (PNPase) in the presence of ethylenediaminetetraacetic acid (Na2 EDTA)


J Med Chem 38: 1005-14 (1995)


Article DOI: 10.1021/jm00006a020
BindingDB Entry DOI: 10.7270/Q2FF3RDR
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50042361
PNG
(CHEMBL324839 | {3-[2-(2-Amino-6-oxo-1,6-dihydro-pu...)
Show SMILES Nc1nc2n(Cc3ccccc3OCCCP(O)(O)=O)cnc2c(=O)[nH]1
Show InChI InChI=1S/C15H18N5O5P/c16-15-18-13-12(14(21)19-15)17-9-20(13)8-10-4-1-2-5-11(10)25-6-3-7-26(22,23)24/h1-2,4-5,9H,3,6-8H2,(H2,22,23,24)(H3,16,18,19,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
1.00E+3n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of purine nucleoside phosphorylase of human erythrocytes in xanthine oxidase-coupled assay


J Med Chem 36: 3455-63 (1993)


Article DOI: 10.1021/jm00074a029
BindingDB Entry DOI: 10.7270/Q2PR7V1V
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50033661
PNG
(CHEMBL7247 | {[7-(2-Amino-6-oxo-1,6-dihydro-purin-...)
Show SMILES Nc1nc2n(CCCCCCCP(O)(=O)CP(O)(O)=O)cnc2c(=O)[nH]1
Show InChI InChI=1S/C13H23N5O6P2/c14-13-16-11-10(12(19)17-13)15-8-18(11)6-4-2-1-3-5-7-25(20,21)9-26(22,23)24/h8H,1-7,9H2,(H,20,21)(H2,22,23,24)(H3,14,16,17,19)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.10E+3n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte purine nucleoside phosphorylase (PNPase) in the presence of ethylenediaminetetraacetic acid (Na2 EDTA)


J Med Chem 38: 1005-14 (1995)


Article DOI: 10.1021/jm00006a020
BindingDB Entry DOI: 10.7270/Q2FF3RDR
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50033665
PNG
(CHEMBL268378 | {[5-(2-Amino-6-oxo-1,6-dihydro-puri...)
Show SMILES CCOP(O)(=O)CP(O)(=O)CCCCCn1cnc2c1nc(N)[nH]c2=O
Show InChI InChI=1S/C13H23N5O6P2/c1-2-24-26(22,23)9-25(20,21)7-5-3-4-6-18-8-15-10-11(18)16-13(14)17-12(10)19/h8H,2-7,9H2,1H3,(H,20,21)(H,22,23)(H3,14,16,17,19)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.10E+3n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte purine nucleoside phosphorylase (PNPase) in the presence of zinc chloride


J Med Chem 38: 1005-14 (1995)


Article DOI: 10.1021/jm00006a020
BindingDB Entry DOI: 10.7270/Q2FF3RDR
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50033664
PNG
(CHEMBL7068 | {[4-(2-Amino-6-oxo-1,6-dihydro-purin-...)
Show SMILES Nc1nc2n(CCCCP(O)(=O)CP(O)(O)=O)cnc2c(=O)[nH]1
Show InChI InChI=1S/C10H17N5O6P2/c11-10-13-8-7(9(16)14-10)12-5-15(8)3-1-2-4-22(17,18)6-23(19,20)21/h5H,1-4,6H2,(H,17,18)(H2,19,20,21)(H3,11,13,14,16)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.40E+3n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte purine nucleoside phosphorylase (PNPase) in the presence of ethylenediaminetetraacetic acid (Na2 EDTA)


J Med Chem 38: 1005-14 (1995)


Article DOI: 10.1021/jm00006a020
BindingDB Entry DOI: 10.7270/Q2FF3RDR
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50033662
PNG
(CHEMBL7194 | {Hydroxy-[5-(2-hydroxy-6-oxo-1,6-dihy...)
Show SMILES OP(O)(=O)CP(O)(=O)CCCCCn1cnc2c1[nH]c(=O)[nH]c2=O
Show InChI InChI=1S/C11H18N4O7P2/c16-10-8-9(13-11(17)14-10)15(6-12-8)4-2-1-3-5-23(18,19)7-24(20,21)22/h6H,1-5,7H2,(H,18,19)(H2,20,21,22)(H2,13,14,16,17)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.40E+3n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte purine nucleoside phosphorylase (PNPase) in the presence of zinc chloride


J Med Chem 38: 1005-14 (1995)


Article DOI: 10.1021/jm00006a020
BindingDB Entry DOI: 10.7270/Q2FF3RDR
More data for this
Ligand-Target Pair
Histidine decarboxylase


(Rattus norvegicus)
BDBM50010139
PNG
(CHEMBL54664 | L-Histidine Methyl Ester)
Show SMILES COC(=O)[C@@H](N)Cc1c[nH]cn1
Show InChI InChI=1S/C7H11N3O2/c1-12-7(11)6(8)2-5-3-9-4-10-5/h3-4,6H,2,8H2,1H3,(H,9,10)/t6-/m0/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

CHEMBL
KEGG
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
1.80E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of histidine decarboxylase in Sprague-Dawley rat stomach assessed as decrease in 14CO2 production using L-histidine-carboxyl-14C as substr...


J Med Chem 20: 506-9 (1977)


Article DOI: 10.1021/jm00214a009
BindingDB Entry DOI: 10.7270/Q2FN17QW
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50042360
PNG
(CHEMBL117588 | [4-(2-Amino-6-oxo-1,6-dihydro-purin...)
Show SMILES Nc1nc2n(Cc3ccc(COCP(O)(O)=O)cc3)cnc2c(=O)[nH]1
Show InChI InChI=1S/C14H16N5O5P/c15-14-17-12-11(13(20)18-14)16-7-19(12)5-9-1-3-10(4-2-9)6-24-8-25(21,22)23/h1-4,7H,5-6,8H2,(H2,21,22,23)(H3,15,17,18,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
3.50E+3n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of purine nucleoside phosphorylase of human erythrocytes in xanthine oxidase-coupled assay


J Med Chem 36: 3455-63 (1993)


Article DOI: 10.1021/jm00074a029
BindingDB Entry DOI: 10.7270/Q2PR7V1V
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50042368
PNG
(CHEMBL446671 | [4-(2-Amino-6-oxo-1,6-dihydro-purin...)
Show SMILES Nc1nc2n(Cc3ccc(cc3)P(O)(O)=O)cnc2c(=O)[nH]1
Show InChI InChI=1S/C12H12N5O4P/c13-12-15-10-9(11(18)16-12)14-6-17(10)5-7-1-3-8(4-2-7)22(19,20)21/h1-4,6H,5H2,(H2,19,20,21)(H3,13,15,16,18)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
7.00E+3n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of purine nucleoside phosphorylase of human erythrocytes in xanthine oxidase-coupled assay


J Med Chem 36: 3455-63 (1993)


Article DOI: 10.1021/jm00074a029
BindingDB Entry DOI: 10.7270/Q2PR7V1V
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50033665
PNG
(CHEMBL268378 | {[5-(2-Amino-6-oxo-1,6-dihydro-puri...)
Show SMILES CCOP(O)(=O)CP(O)(=O)CCCCCn1cnc2c1nc(N)[nH]c2=O
Show InChI InChI=1S/C13H23N5O6P2/c1-2-24-26(22,23)9-25(20,21)7-5-3-4-6-18-8-15-10-11(18)16-13(14)17-12(10)19/h8H,2-7,9H2,1H3,(H,20,21)(H,22,23)(H3,14,16,17,19)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.40E+4n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte purine nucleoside phosphorylase (PNPase) in the presence of ethylenediaminetetraacetic acid (Na2 EDTA)


J Med Chem 38: 1005-14 (1995)


Article DOI: 10.1021/jm00006a020
BindingDB Entry DOI: 10.7270/Q2FF3RDR
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50033662
PNG
(CHEMBL7194 | {Hydroxy-[5-(2-hydroxy-6-oxo-1,6-dihy...)
Show SMILES OP(O)(=O)CP(O)(=O)CCCCCn1cnc2c1[nH]c(=O)[nH]c2=O
Show InChI InChI=1S/C11H18N4O7P2/c16-10-8-9(13-11(17)14-10)15(6-12-8)4-2-1-3-5-23(18,19)7-24(20,21)22/h6H,1-5,7H2,(H,18,19)(H2,20,21,22)(H2,13,14,16,17)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
2.70E+5n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte purine nucleoside phosphorylase (PNPase) in the presence of ethylenediaminetetraacetic acid (Na2 EDTA)


J Med Chem 38: 1005-14 (1995)


Article DOI: 10.1021/jm00006a020
BindingDB Entry DOI: 10.7270/Q2FF3RDR
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50042371
PNG
(CHEMBL327003 | [4-(2-Amino-6-oxo-1,6-dihydro-purin...)
Show SMILES Nc1nc2n(Cc3ccc(OCP(O)(O)=O)cc3)cnc2c(=O)[nH]1
Show InChI InChI=1S/C13H14N5O5P/c14-13-16-11-10(12(19)17-13)15-6-18(11)5-8-1-3-9(4-2-8)23-7-24(20,21)22/h1-4,6H,5,7H2,(H2,20,21,22)(H3,14,16,17,19)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
2.70E+5n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of purine nucleoside phosphorylase of human erythrocytes in xanthine oxidase-coupled assay


J Med Chem 36: 3455-63 (1993)


Article DOI: 10.1021/jm00074a029
BindingDB Entry DOI: 10.7270/Q2PR7V1V
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50007518
PNG
((S)-3-chloro-5-ethyl-N-((1-ethylpyrrolidin-2-yl)me...)
Show SMILES CCN1CCC[C@H]1CNC(=O)c1c(O)c(CC)cc(Cl)c1OC
Show InChI InChI=1S/C17H25ClN2O3/c1-4-11-9-13(18)16(23-3)14(15(11)21)17(22)19-10-12-7-6-8-20(12)5-2/h9,12,21H,4-8,10H2,1-3H3,(H,19,22)/t12-/m0/s1
Reactome pathway
KEGG

GoogleScholar
Purchase

CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
PubMed
n/an/a 0.920n/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibition of [3H]spiperone binding to dopamine receptor D2


J Med Chem 36: 3417-23 (1993)


Article DOI: 10.1021/jm00074a023
BindingDB Entry DOI: 10.7270/Q2S75GZD
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50007534
PNG
(3-Bromo-N-((S)-1-ethyl-pyrrolidin-2-ylmethyl)-2-hy...)
Show SMILES CCN1CCC[C@H]1CNC(=O)c1c(O)c(Br)ccc1OC
Show InChI InChI=1S/C15H21BrN2O3/c1-3-18-8-4-5-10(18)9-17-15(20)13-12(21-2)7-6-11(16)14(13)19/h6-7,10,19H,3-5,8-9H2,1-2H3,(H,17,20)/t10-/m0/s1
Reactome pathway
KEGG

GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 12n/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibition of [3H]spiperone binding to dopamine receptor D2


J Med Chem 36: 3417-23 (1993)


Article DOI: 10.1021/jm00074a023
BindingDB Entry DOI: 10.7270/Q2S75GZD
More data for this
Ligand-Target Pair
Uridine phosphorylase 1


(Mus musculus)
BDBM50030972
PNG
(5-(3-sec-Butoxy-benzyl)-1-(2-hydroxy-ethoxymethyl)...)
Show SMILES CCC(C)Oc1cccc(Cc2cn(COCCO)c(=O)[nH]c2=O)c1
Show InChI InChI=1S/C18H24N2O5/c1-3-13(2)25-16-6-4-5-14(10-16)9-15-11-20(12-24-8-7-21)18(23)19-17(15)22/h4-6,10-11,13,21H,3,7-9,12H2,1-2H3,(H,19,22,23)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 27n/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of uridine phosphorylase (UrdPase) from murine liver.


J Med Chem 38: 3850-6 (1995)


Article DOI: 10.1021/jm00019a015
BindingDB Entry DOI: 10.7270/Q2B27T91
More data for this
Ligand-Target Pair
Uridine phosphorylase 1


(Mus musculus)
BDBM50031005
PNG
(1-(2-Hydroxy-ethoxymethyl)-5-(3-propoxy-benzyl)-1H...)
Show SMILES CCCOc1cccc(Cc2cn(COCCO)c(=O)[nH]c2=O)c1
Show InChI InChI=1S/C17H22N2O5/c1-2-7-24-15-5-3-4-13(10-15)9-14-11-19(12-23-8-6-20)17(22)18-16(14)21/h3-5,10-11,20H,2,6-9,12H2,1H3,(H,18,21,22)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 47n/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of uridine phosphorylase (UrdPase) from murine liver.


J Med Chem 38: 3850-6 (1995)


Article DOI: 10.1021/jm00019a015
BindingDB Entry DOI: 10.7270/Q2B27T91
More data for this
Ligand-Target Pair
Uridine phosphorylase 1


(Mus musculus)
BDBM50030974
PNG
(1-(2-Hydroxy-1-hydroxymethyl-ethoxymethyl)-5-(3-pr...)
Show SMILES CCCOc1cccc(Cc2cn(COC(CO)CO)c(=O)[nH]c2=O)c1
Show InChI InChI=1S/C18H24N2O6/c1-2-6-25-15-5-3-4-13(8-15)7-14-9-20(18(24)19-17(14)23)12-26-16(10-21)11-22/h3-5,8-9,16,21-22H,2,6-7,10-12H2,1H3,(H,19,23,24)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 60n/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of uridine phosphorylase (UrdPase) from murine liver.


J Med Chem 38: 3850-6 (1995)


Article DOI: 10.1021/jm00019a015
BindingDB Entry DOI: 10.7270/Q2B27T91
More data for this
Ligand-Target Pair
Uridine phosphorylase 1


(Mus musculus)
BDBM50031009
PNG
(1-(2-Hydroxy-ethoxymethyl)-5-(3-isobutoxy-benzyl)-...)
Show SMILES CC(C)COc1cccc(Cc2cn(COCCO)c(=O)[nH]c2=O)c1
Show InChI InChI=1S/C18H24N2O5/c1-13(2)11-25-16-5-3-4-14(9-16)8-15-10-20(12-24-7-6-21)18(23)19-17(15)22/h3-5,9-10,13,21H,6-8,11-12H2,1-2H3,(H,19,22,23)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 66n/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of uridine phosphorylase (UrdPase) from murine liver.


J Med Chem 38: 3850-6 (1995)


Article DOI: 10.1021/jm00019a015
BindingDB Entry DOI: 10.7270/Q2B27T91
More data for this
Ligand-Target Pair
Uridine phosphorylase 1


(Mus musculus)
BDBM50030990
PNG
(5-[3-(3-Fluoro-propoxy)-benzyl]-1-(2-hydroxy-ethox...)
Show SMILES OCCOCn1cc(Cc2cccc(OCCCF)c2)c(=O)[nH]c1=O
Show InChI InChI=1S/C17H21FN2O5/c18-5-2-7-25-15-4-1-3-13(10-15)9-14-11-20(12-24-8-6-21)17(23)19-16(14)22/h1,3-4,10-11,21H,2,5-9,12H2,(H,19,22,23)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 68n/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of uridine phosphorylase (UrdPase) from murine liver.


J Med Chem 38: 3850-6 (1995)


Article DOI: 10.1021/jm00019a015
BindingDB Entry DOI: 10.7270/Q2B27T91
More data for this
Ligand-Target Pair
Uridine phosphorylase 1


(Mus musculus)
BDBM50030980
PNG
(1-((2-HYDROXYETHOXY)METHYL)-5-(3-(BENZYLOXY)BENZYL...)
Show SMILES OCCOCn1cc(Cc2cccc(OCc3ccccc3)c2)c(=O)[nH]c1=O
Show InChI InChI=1S/C21H22N2O5/c24-9-10-27-15-23-13-18(20(25)22-21(23)26)11-17-7-4-8-19(12-17)28-14-16-5-2-1-3-6-16/h1-8,12-13,24H,9-11,14-15H2,(H,22,25,26)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem

Similars

Article
PubMed
n/an/a 84n/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of uridine phosphorylase (UrdPase) from murine liver.


J Med Chem 38: 3850-6 (1995)


Article DOI: 10.1021/jm00019a015
BindingDB Entry DOI: 10.7270/Q2B27T91
More data for this
Ligand-Target Pair
Uridine phosphorylase 1


(Mus musculus)
BDBM50031006
PNG
(5-(3-Ethoxy-benzyl)-1-(2-hydroxy-ethoxymethyl)-1H-...)
Show SMILES CCOc1cccc(Cc2cn(COCCO)c(=O)[nH]c2=O)c1
Show InChI InChI=1S/C16H20N2O5/c1-2-23-14-5-3-4-12(9-14)8-13-10-18(11-22-7-6-19)16(21)17-15(13)20/h3-5,9-10,19H,2,6-8,11H2,1H3,(H,17,20,21)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 100n/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of uridine phosphorylase (UrdPase) from murine liver.


J Med Chem 38: 3850-6 (1995)


Article DOI: 10.1021/jm00019a015
BindingDB Entry DOI: 10.7270/Q2B27T91
More data for this
Ligand-Target Pair
Uridine phosphorylase 1


(Mus musculus)
BDBM50031007
PNG
(5-[3-(3-Fluoro-propoxy)-benzyl]-1-(2-hydroxy-1-hyd...)
Show SMILES OCC(CO)OCn1cc(Cc2cccc(OCCCF)c2)c(=O)[nH]c1=O
Show InChI InChI=1S/C18H23FN2O6/c19-5-2-6-26-15-4-1-3-13(8-15)7-14-9-21(18(25)20-17(14)24)12-27-16(10-22)11-23/h1,3-4,8-9,16,22-23H,2,5-7,10-12H2,(H,20,24,25)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 110n/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of uridine phosphorylase (UrdPase) from murine liver.


J Med Chem 38: 3850-6 (1995)


Article DOI: 10.1021/jm00019a015
BindingDB Entry DOI: 10.7270/Q2B27T91
More data for this
Ligand-Target Pair
Uridine phosphorylase 1


(Mus musculus)
BDBM50030999
PNG
(5-(3-Chloro-benzyl)-1-(2-hydroxy-1-hydroxymethyl-e...)
Show SMILES OCC(CO)OCn1cc(Cc2cccc(Cl)c2)c(=O)[nH]c1=O
Show InChI InChI=1S/C15H17ClN2O5/c16-12-3-1-2-10(5-12)4-11-6-18(15(22)17-14(11)21)9-23-13(7-19)8-20/h1-3,5-6,13,19-20H,4,7-9H2,(H,17,21,22)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 110n/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of uridine phosphorylase (UrdPase) from murine liver.


J Med Chem 38: 3850-6 (1995)


Article DOI: 10.1021/jm00019a015
BindingDB Entry DOI: 10.7270/Q2B27T91
More data for this
Ligand-Target Pair
Uridine phosphorylase 1


(Mus musculus)
BDBM50030983
PNG
(5-(3-Allyloxy-benzyl)-1-(2-hydroxy-ethoxymethyl)-1...)
Show SMILES OCCOCn1cc(Cc2cccc(OCC=C)c2)c(=O)[nH]c1=O
Show InChI InChI=1S/C17H20N2O5/c1-2-7-24-15-5-3-4-13(10-15)9-14-11-19(12-23-8-6-20)17(22)18-16(14)21/h2-5,10-11,20H,1,6-9,12H2,(H,18,21,22)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 130n/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of uridine phosphorylase (UrdPase) from murine liver.


J Med Chem 38: 3850-6 (1995)


Article DOI: 10.1021/jm00019a015
BindingDB Entry DOI: 10.7270/Q2B27T91
More data for this
Ligand-Target Pair
Uridine phosphorylase 1


(Mus musculus)
BDBM50031004
PNG
(1-(2-Hydroxy-ethoxymethyl)-5-(3-isopropoxy-benzyl)...)
Show SMILES CC(C)Oc1cccc(Cc2cn(COCCO)c(=O)[nH]c2=O)c1
Show InChI InChI=1S/C17H22N2O5/c1-12(2)24-15-5-3-4-13(9-15)8-14-10-19(11-23-7-6-20)17(22)18-16(14)21/h3-5,9-10,12,20H,6-8,11H2,1-2H3,(H,18,21,22)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 160n/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of uridine phosphorylase (UrdPase) from murine liver.


J Med Chem 38: 3850-6 (1995)


Article DOI: 10.1021/jm00019a015
BindingDB Entry DOI: 10.7270/Q2B27T91
More data for this
Ligand-Target Pair
Uridine phosphorylase 1


(Mus musculus)
BDBM50030995
PNG
(5-(3-Butoxy-benzyl)-1-(2-hydroxy-ethoxymethyl)-1H-...)
Show SMILES CCCCOc1cccc(Cc2cn(COCCO)c(=O)[nH]c2=O)c1
Show InChI InChI=1S/C18H24N2O5/c1-2-3-8-25-16-6-4-5-14(11-16)10-15-12-20(13-24-9-7-21)18(23)19-17(15)22/h4-6,11-12,21H,2-3,7-10,13H2,1H3,(H,19,22,23)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 160n/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of uridine phosphorylase (UrdPase) from murine liver.


J Med Chem 38: 3850-6 (1995)


Article DOI: 10.1021/jm00019a015
BindingDB Entry DOI: 10.7270/Q2B27T91
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50122955
PNG
(2-(4,6-Difluoro-indan-1-ylidene)-acetamide | CHEMB...)
Show SMILES NC(=O)\C=C1/CCc2c1cc(F)cc2F
Show InChI InChI=1S/C11H9F2NO/c12-7-4-9-6(3-11(14)15)1-2-8(9)10(13)5-7/h3-5H,1-2H2,(H2,14,15)/b6-3+
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 200n/an/an/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against Monoamine oxidase B (MAO-B)


J Med Chem 46: 399-408 (2003)


Article DOI: 10.1021/jm020067s
BindingDB Entry DOI: 10.7270/Q2VH5N7F
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM11638
PNG
(CHEMBL26 | Compound 7 | N-[(1-ethylpyrrolidin-2-yl...)
Show SMILES CCN1CCCC1CNC(=O)c1cc(ccc1OC)S(N)(=O)=O
Show InChI InChI=1S/C15H23N3O4S/c1-3-18-8-4-5-11(18)10-17-15(19)13-9-12(23(16,20)21)6-7-14(13)22-2/h6-7,9,11H,3-5,8,10H2,1-2H3,(H,17,19)(H2,16,20,21)
Reactome pathway
KEGG

GoogleScholar
Purchase

CHEMBL
DrugBank
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 210n/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibition of [3H]spiperone binding to dopamine receptor D2


J Med Chem 36: 3417-23 (1993)


Article DOI: 10.1021/jm00074a023
BindingDB Entry DOI: 10.7270/Q2S75GZD
More data for this
Ligand-Target Pair
Uridine phosphorylase 1


(Mus musculus)
BDBM50030984
PNG
(5-(3-Chloro-benzyl)-1-(2-hydroxy-ethoxymethyl)-1H-...)
Show SMILES OCCOCn1cc(Cc2cccc(Cl)c2)c(=O)[nH]c1=O
Show InChI InChI=1S/C14H15ClN2O4/c15-12-3-1-2-10(7-12)6-11-8-17(9-21-5-4-18)14(20)16-13(11)19/h1-3,7-8,18H,4-6,9H2,(H,16,19,20)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 300n/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of uridine phosphorylase (UrdPase) from murine liver.


J Med Chem 38: 3850-6 (1995)


Article DOI: 10.1021/jm00019a015
BindingDB Entry DOI: 10.7270/Q2B27T91
More data for this
Ligand-Target Pair
Uridine phosphorylase 1


(Mus musculus)
BDBM50030981
PNG
(5-(3,5-Difluoro-benzyl)-1-(2-hydroxy-ethoxymethyl)...)
Show SMILES OCCOCn1cc(Cc2cc(F)cc(F)c2)c(=O)[nH]c1=O
Show InChI InChI=1S/C14H14F2N2O4/c15-11-4-9(5-12(16)6-11)3-10-7-18(8-22-2-1-19)14(21)17-13(10)20/h4-7,19H,1-3,8H2,(H,17,20,21)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 350n/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of uridine phosphorylase (UrdPase) from murine liver.


J Med Chem 38: 3850-6 (1995)


Article DOI: 10.1021/jm00019a015
BindingDB Entry DOI: 10.7270/Q2B27T91
More data for this
Ligand-Target Pair
Uridine phosphorylase 1


(Mus musculus)
BDBM50026387
PNG
(1-((2-HYDROXYETHOXY)METHYL)-5-BENZYLPYRIMIDINE-2,4...)
Show SMILES OCCOCn1cc(Cc2ccccc2)c(=O)[nH]c1=O
Show InChI InChI=1S/C14H16N2O4/c17-6-7-20-10-16-9-12(13(18)15-14(16)19)8-11-4-2-1-3-5-11/h1-5,9,17H,6-8,10H2,(H,15,18,19)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
PubMed
n/an/a 460n/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of uridine phosphorylase (UrdPase) from murine liver.


J Med Chem 38: 3850-6 (1995)


Article DOI: 10.1021/jm00019a015
BindingDB Entry DOI: 10.7270/Q2B27T91
More data for this
Ligand-Target Pair
Uridine phosphorylase 1


(Mus musculus)
BDBM50030976
PNG
(5-(3-Fluoro-benzyl)-1-(2-hydroxy-ethoxymethyl)-1H-...)
Show SMILES OCCOCn1cc(Cc2cccc(F)c2)c(=O)[nH]c1=O
Show InChI InChI=1S/C14H15FN2O4/c15-12-3-1-2-10(7-12)6-11-8-17(9-21-5-4-18)14(20)16-13(11)19/h1-3,7-8,18H,4-6,9H2,(H,16,19,20)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 550n/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of uridine phosphorylase (UrdPase) from murine liver.


J Med Chem 38: 3850-6 (1995)


Article DOI: 10.1021/jm00019a015
BindingDB Entry DOI: 10.7270/Q2B27T91
More data for this
Ligand-Target Pair
Thymidylate synthase/GAR transformylase/AICAR transformylase


(Homo sapiens (Human))
BDBM50005520
PNG
((S)-2-{4-[3-(2,4-Diamino-6-oxo-1,6-dihydro-pyrimid...)
Show SMILES Nc1nc(N)c(CCCNc2ccc(cc2)C(=O)N[C@@H](CCC(O)=O)C(O)=O)c(=O)[nH]1
Show InChI InChI=1S/C19H24N6O6/c20-15-12(17(29)25-19(21)24-15)2-1-9-22-11-5-3-10(4-6-11)16(28)23-13(18(30)31)7-8-14(26)27/h3-6,13,22H,1-2,7-9H2,(H,23,28)(H,26,27)(H,30,31)(H5,20,21,24,25,29)/t13-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 700n/an/an/an/an/an/a



Wellcome Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition activity against Glycinamide ribonucleotide transformylase(GAR-TFase) against hog liver


J Med Chem 33: 561-7 (1990)


Article DOI: 10.1021/jm00164a014
BindingDB Entry DOI: 10.7270/Q2XW4HS0
More data for this
Ligand-Target Pair
Displayed 1 to 50 (of 98 total )  |  Next  |  Last  >>
Jump to: