BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 749 hits of affinity data for UniProtKB/TrEMBL: P35557    Zinc 0: unavailable per Zinc DB. Zinc 1: purchasable, 2 weeks to supply. Zinc 2: made on demand. Zinc 4: potentially available
Target
(Institution)
LigandTarget
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
Glucokinase


(Homo sapiens (Human))
CHEMBL584052
PNG
(10-(4-hydroxyphenyl)-8,13,15-triazatetracyclo[9.6....)
Show SMILES Oc1ccc(cc1)C1c2c[nH]c3nccc(-c4ccccc4NC1=O)c23
Show InChI InChI=1S/C21H15N3O2/c25-13-7-5-12(6-8-13)18-16-11-23-20-19(16)15(9-10-22-20)14-3-1-2-4-17(14)24-21(18)26/h1-11,18,25H,(H,22,23)(H,24,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
PDB
UniChem
ZINC 0

Patents


Cmpd Page

AffyNet 
Article
PubMed
340.0n/an/an/an/an/an/an/an/a



Vertex Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of GCK


Citation and Details
corrected by BindingDB staff
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3113985
PNG
Show SMILES CC(O)(c1ccc(cc1)N1CCN(C[C@@H]1CN1C2CCC1COC2)S(=O)(=O)c1cccs1)C(F)(F)F
Show InChI InChI=1S/C24H30F3N3O4S2/c1-23(31,24(25,26)27)17-4-6-18(7-5-17)29-11-10-28(36(32,33)22-3-2-12-35-22)13-21(29)14-30-19-8-9-20(30)16-34-15-19/h2-7,12,19-21,31H,8-11,13-16H2,1H3/t19?,20?,21-,23?/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 2.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3114185
PNG
Show SMILES CC#C[C@H]1CN(CCN1c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(N)nc1
Show InChI InChI=1S/C21H20F6N4O3S/c1-2-3-16-13-30(35(33,34)17-8-9-18(28)29-12-17)10-11-31(16)15-6-4-14(5-7-15)19(32,20(22,23)24)21(25,26)27/h4-9,12,16,32H,10-11,13H2,1H3,(H2,28,29)/t16-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 4.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3114183
PNG
Show SMILES CC#CC1CN(CCN1c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(N)nc1
Show InChI InChI=1S/C21H20F6N4O3S/c1-2-3-16-13-30(35(33,34)17-8-9-18(28)29-12-17)10-11-31(16)15-6-4-14(5-7-15)19(32,20(22,23)24)21(25,26)27/h4-9,12,16,32H,10-11,13H2,1H3,(H2,28,29)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 6.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3114186
PNG
Show SMILES CC#C[C@H]1CN(CCN1c1ccc(cc1)[C@](C)(O)C(F)(F)F)S(=O)(=O)c1ccc(N)nc1
Show InChI InChI=1S/C21H23F3N4O3S/c1-3-4-17-14-27(32(30,31)18-9-10-19(25)26-13-18)11-12-28(17)16-7-5-15(6-8-16)20(2,29)21(22,23)24/h5-10,13,17,29H,11-12,14H2,1-2H3,(H2,25,26)/t17-,20-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 6.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3113980
PNG
Show SMILES C[C@H]1COCCN1C[C@H]1CN(CCN1c1ccc(cc1)C(C)(O)C(F)(F)F)S(=O)(=O)c1cccs1
Show InChI InChI=1S/C23H30F3N3O4S2/c1-17-16-33-12-11-27(17)14-20-15-28(35(31,32)21-4-3-13-34-21)9-10-29(20)19-7-5-18(6-8-19)22(2,30)23(24,25)26/h3-8,13,17,20,30H,9-12,14-16H2,1-2H3/t17-,20-,22?/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 7.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3114187
PNG
Show SMILES CC#C[C@H]1CN(CCN1c1ccc(cc1)[C@@](C)(O)C(F)(F)F)S(=O)(=O)c1ccc(N)nc1
Show InChI InChI=1S/C21H23F3N4O3S/c1-3-4-17-14-27(32(30,31)18-9-10-19(25)26-13-18)11-12-28(17)16-7-5-15(6-8-16)20(2,29)21(22,23)24/h5-10,13,17,29H,11-12,14H2,1-2H3,(H2,25,26)/t17-,20+/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 9.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3113988
PNG
Show SMILES C[C@@](O)(c1ccc(cc1)N1CCN(C[C@@H]1CN1[C@@H]2C[C@@H](O)[C@H]1COC2)S(=O)(=O)c1cccs1)C(F)(F)F
Show InChI InChI=1S/C24H30F3N3O5S2/c1-23(32,24(25,26)27)16-4-6-17(7-5-16)29-9-8-28(37(33,34)22-3-2-10-36-22)12-19(29)13-30-18-11-21(31)20(30)15-35-14-18/h2-7,10,18-21,31-32H,8-9,11-15H2,1H3/t18-,19-,20-,21-,23-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 14.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3113989
PNG
Show SMILES C[C@](O)(c1ccc(cc1)N1CCN(C[C@@H]1CN1[C@@H]2C[C@@H](O)[C@H]1COC2)S(=O)(=O)c1cccs1)C(F)(F)F
Show InChI InChI=1S/C24H30F3N3O5S2/c1-23(32,24(25,26)27)16-4-6-17(7-5-16)29-9-8-28(37(33,34)22-3-2-10-36-22)12-19(29)13-30-18-11-21(31)20(30)15-35-14-18/h2-7,10,18-21,31-32H,8-9,11-15H2,1H3/t18-,19-,20-,21-,23+/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 16.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3113990
PNG
Show SMILES C[C@@](O)(c1ccc(cc1)N1CCN(C[C@@H]1CN1[C@H]2C[C@H](O)[C@@H]1COC2)S(=O)(=O)c1cccs1)C(F)(F)F
Show InChI InChI=1S/C24H30F3N3O5S2/c1-23(32,24(25,26)27)16-4-6-17(7-5-16)29-9-8-28(37(33,34)22-3-2-10-36-22)12-19(29)13-30-18-11-21(31)20(30)15-35-14-18/h2-7,10,18-21,31-32H,8-9,11-15H2,1H3/t18-,19+,20-,21-,23+/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 25.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3113987
PNG
Show SMILES CC(O)(c1ccc(cc1)N1CCN(C[C@@H]1CN1[C@@H]2C[C@H](O)[C@@H]1COC2)S(=O)(=O)c1cccs1)C(F)(F)F
Show InChI InChI=1S/C24H30F3N3O5S2/c1-23(32,24(25,26)27)16-4-6-17(7-5-16)29-9-8-28(37(33,34)22-3-2-10-36-22)12-19(29)13-30-18-11-21(31)20(30)15-35-14-18/h2-7,10,18-21,31-32H,8-9,11-15H2,1H3/t18-,19-,20+,21+,23?/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 26.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3113986
PNG
Show SMILES CC(O)(c1ccc(cc1)N1CCN(C[C@@H]1CN1[C@@H]2C[C@@H](O)[C@@H]1COC2)S(=O)(=O)c1cccs1)C(F)(F)F
Show InChI InChI=1S/C24H30F3N3O5S2/c1-23(32,24(25,26)27)16-4-6-17(7-5-16)29-9-8-28(37(33,34)22-3-2-10-36-22)12-19(29)13-30-18-11-21(31)20(30)15-35-14-18/h2-7,10,18-21,31-32H,8-9,11-15H2,1H3/t18-,19-,20+,21-,23?/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 44.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3114188
PNG
Show SMILES CCC#CC1CN(CCN1c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(N)nc1
Show InChI InChI=1S/C22H22F6N4O3S/c1-2-3-4-17-14-31(36(34,35)18-9-10-19(29)30-13-18)11-12-32(17)16-7-5-15(6-8-16)20(33,21(23,24)25)22(26,27)28/h5-10,13,17,33H,2,11-12,14H2,1H3,(H2,29,30)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 56.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3113991
PNG
Show SMILES C[C@](O)(c1ccc(cc1)N1CCN(C[C@@H]1CN1[C@H]2C[C@H](O)[C@@H]1COC2)S(=O)(=O)c1cccs1)C(F)(F)F
Show InChI InChI=1S/C24H30F3N3O5S2/c1-23(32,24(25,26)27)16-4-6-17(7-5-16)29-9-8-28(37(33,34)22-3-2-10-36-22)12-19(29)13-30-18-11-21(31)20(30)15-35-14-18/h2-7,10,18-21,31-32H,8-9,11-15H2,1H3/t18-,19+,20-,21-,23-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 56.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens)
CHEMBL2064666
PNG
Show SMILES COc1c(Nc2ncc(Cl)c(N[C@@H]3[C@@H]4C[C@@H](C=C4)[C@@H]3C(N)=O)n2)ccc2CC[C@@H](CCc12)N1CCOCC1
Show InChI InChI=1S/C28H35ClN6O3/c1-37-25-20-8-7-19(35-10-12-38-13-11-35)6-4-16(20)5-9-22(25)32-28-31-15-21(29)27(34-28)33-24-18-3-2-17(14-18)23(24)26(30)36/h2-3,5,9,15,17-19,23-24H,4,6-8,10-14H2,1H3,(H2,30,36)(H2,31,32,33,34)/t17-,18+,19+,23+,24-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
ZINC 0

Similars

AffyNet 
Article
PubMed
n/an/a 60.0n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human GCK


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3114000
PNG
Show SMILES Nc1ccc(cn1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C18H18F6N4O3S/c19-17(20,21)16(29,18(22,23)24)12-1-3-13(4-2-12)27-7-9-28(10-8-27)32(30,31)14-5-6-15(25)26-11-14/h1-6,11,29H,7-10H2,(H2,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 87.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3113983
PNG
Show SMILES CC1CS(=O)(=O)CCN1C[C@H]1CN(CCN1c1ccc(cc1)C(C)(O)C(F)(F)F)S(=O)(=O)c1cccs1
Show InChI InChI=1S/C23H30F3N3O5S3/c1-17-16-36(31,32)13-11-27(17)14-20-15-28(37(33,34)21-4-3-12-35-21)9-10-29(20)19-7-5-18(6-8-19)22(2,30)23(24,25)26/h3-8,12,17,20,30H,9-11,13-16H2,1-2H3/t17?,20-,22?/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 90.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3113994
PNG
Show SMILES Nc1ccc(s1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C17H17F6N3O3S2/c18-16(19,20)15(27,17(21,22)23)11-1-3-12(4-2-11)25-7-9-26(10-8-25)31(28,29)14-6-5-13(24)30-14/h1-6,27H,7-10,24H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 252.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3114001
PNG
Show SMILES Nc1ncc(cn1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C17H17F6N5O3S/c18-16(19,20)15(29,17(21,22)23)11-1-3-12(4-2-11)27-5-7-28(8-6-27)32(30,31)13-9-25-14(24)26-10-13/h1-4,9-10,29H,5-8H2,(H2,24,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 316.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3113995
PNG
Show SMILES Nc1csc(c1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C17H17F6N3O3S2/c18-16(19,20)15(27,17(21,22)23)11-1-3-13(4-2-11)25-5-7-26(8-6-25)31(28,29)14-9-12(24)10-30-14/h1-4,9-10,27H,5-8,24H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 324.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3113982
PNG
Show SMILES CC(O)(c1ccc(cc1)N1CCN(C[C@@H]1CN1CCS(=O)(=O)CC1)S(=O)(=O)c1cccs1)C(F)(F)F
Show InChI InChI=1S/C22H28F3N3O5S3/c1-21(29,22(23,24)25)17-4-6-18(7-5-17)28-9-8-27(36(32,33)20-3-2-12-34-20)16-19(28)15-26-10-13-35(30,31)14-11-26/h2-7,12,19,29H,8-11,13-16H2,1H3/t19-,21?/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 343.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3113981
PNG
Show SMILES CC(O)(c1ccc(cc1)N1CCN(C[C@@H]1CN1CCC(F)(F)CC1)S(=O)(=O)c1cccs1)C(F)(F)F
Show InChI InChI=1S/C23H28F5N3O3S2/c1-21(32,23(26,27)28)17-4-6-18(7-5-17)31-13-12-30(36(33,34)20-3-2-14-35-20)16-19(31)15-29-10-8-22(24,25)9-11-29/h2-7,14,19,32H,8-13,15-16H2,1H3/t19-,21?/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 439.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3113996
PNG
Show SMILES Nc1ccccc1S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C19H19F6N3O3S/c20-18(21,22)17(29,19(23,24)25)13-5-7-14(8-6-13)27-9-11-28(12-10-27)32(30,31)16-4-2-1-3-15(16)26/h1-8,29H,9-12,26H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 445.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3113998
PNG
Show SMILES Nc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C19H19F6N3O3S/c20-18(21,22)17(29,19(23,24)25)13-1-5-15(6-2-13)27-9-11-28(12-10-27)32(30,31)16-7-3-14(26)4-8-16/h1-8,29H,9-12,26H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 484.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3114184
PNG
Show SMILES CC#C[C@@H]1CN(CCN1c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(N)nc1
Show InChI InChI=1S/C21H20F6N4O3S/c1-2-3-16-13-30(35(33,34)17-8-9-18(28)29-12-17)10-11-31(16)15-6-4-14(5-7-15)19(32,20(22,23)24)21(25,26)27/h4-9,12,16,32H,10-11,13H2,1H3,(H2,28,29)/t16-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 484.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3113984
PNG
Show SMILES CC(O)(c1ccc(cc1)N1CCN(C[C@@H]1CN1CC2(COC2)C1)S(=O)(=O)c1cccs1)C(F)(F)F
Show InChI InChI=1S/C23H28F3N3O4S2/c1-21(30,23(24,25)26)17-4-6-18(7-5-17)29-9-8-28(35(31,32)20-3-2-10-34-20)12-19(29)11-27-13-22(14-27)15-33-16-22/h2-7,10,19,30H,8-9,11-16H2,1H3/t19-,21?/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 524.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3113997
PNG
Show SMILES Nc1cccc(c1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C19H19F6N3O3S/c20-18(21,22)17(29,19(23,24)25)13-4-6-15(7-5-13)27-8-10-28(11-9-27)32(30,31)16-3-1-2-14(26)12-16/h1-7,12,29H,8-11,26H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 645.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3114189
PNG
Show SMILES Nc1ccc(cn1)S(=O)(=O)N1CCN(C(C1)C#CC1CC1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C23H22F6N4O3S/c24-22(25,26)21(34,23(27,28)29)16-4-7-17(8-5-16)33-12-11-32(14-18(33)6-3-15-1-2-15)37(35,36)19-9-10-20(30)31-13-19/h4-5,7-10,13,15,18,34H,1-2,11-12,14H2,(H2,30,31)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 779.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3113993
PNG
Show SMILES OC(c1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1ccccc1)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C19H18F6N2O3S/c20-18(21,22)17(28,19(23,24)25)14-6-8-15(9-7-14)26-10-12-27(13-11-26)31(29,30)16-4-2-1-3-5-16/h1-9,28H,10-13H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 1010.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens)
CHEMBL1080994
PNG
(4-(4-methyl-1H-indol-5-ylamino)-5-(3-(4-methylpipe...)
Show SMILES CN1CCN(CC1)S(=O)(=O)c1cccc(\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)c1
Show InChI InChI=1S/C28H28N6O2S/c1-20-25-10-11-31-27(25)9-8-26(20)32-28-22(18-30-19-23(28)17-29)7-6-21-4-3-5-24(16-21)37(35,36)34-14-12-33(2)13-15-34/h3-11,16,18-19,31H,12-15H2,1-2H3,(H,30,32)/b7-6+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
ZINC 0

Similars

AffyNet 
Article
PubMed
n/an/a 1300.0n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of GCK


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3113992
PNG
Show SMILES OC(c1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1cccs1)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C17H16F6N2O3S2/c18-16(19,20)15(26,17(21,22)23)12-3-5-13(6-4-12)24-7-9-25(10-8-24)30(27,28)14-2-1-11-29-14/h1-6,11,26H,7-10H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
PDB
UniChem
AffyNet 
Article
PubMed
n/an/a 1420.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3114190
PNG
Show SMILES CC(C)(C)C#CC1CN(CCN1c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(N)nc1
Show InChI InChI=1S/C24H26F6N4O3S/c1-21(2,3)11-10-18-15-33(38(36,37)19-8-9-20(31)32-14-19)12-13-34(18)17-6-4-16(5-7-17)22(35,23(25,26)27)24(28,29)30/h4-9,14,18,35H,12-13,15H2,1-3H3,(H2,31,32)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 1430.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase (GCK)


(Homo sapiens (Human))
Kinase inhibitor, A2
PNG
Show SMILES Nc1cnc2c(cccn2c1=O)-c1c(F)cccc1F
Show InChI InChI=1S/C14H9F2N3O/c15-9-4-1-5-10(16)12(9)8-3-2-6-19-13(8)18-7-11(17)14(19)20/h1-7H,17H2
PDB
MMDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
ZINC 0
AffyNet 
Article
PubMed
n/an/a 4000.0n/an/an/an/an/an/a



University of Dundee



Assay Description
Selected compounds were screened against a panel of mammalian kinases. Compounds were supplied in DMSO and screened in duplicates at 100 uM concentr...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens)
CHEMBL1087650
PNG
(3-(7-(4-((1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]h...)
Show SMILES CN1C[C@@H]2C[C@H]1CN2c1ccc(cc1)-c1ccnc2c(c(nn12)-c1ccncc1)-c1cccc(O)c1
Show InChI InChI=1S/C29H26N6O/c1-33-17-24-16-23(33)18-34(24)22-7-5-19(6-8-22)26-11-14-31-29-27(21-3-2-4-25(36)15-21)28(32-35(26)29)20-9-12-30-13-10-20/h2-15,23-24,36H,16-18H2,1H3/t23-,24-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
ZINC 0

Similars

AffyNet 
Article
PubMed
n/an/a 4100.0n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of GCK


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase (GCK)


(Homo sapiens (Human))
Kinase inhibitor, B1
PNG
Show SMILES Nc1nc2cnc(cn2n1)-c1ccccc1
Show InChI InChI=1S/C11H9N5/c12-11-14-10-6-13-9(7-16(10)15-11)8-4-2-1-3-5-8/h1-7H,(H2,12,15)
PDB
MMDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem
ZINC 0
AffyNet 
Article
PubMed
n/an/a 6000.0n/an/an/an/an/an/a



University of Dundee



Assay Description
Selected compounds were screened against a panel of mammalian kinases. Compounds were supplied in DMSO and screened in duplicates at 100 uM concentr...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL3113999
PNG
Show SMILES Nc1cc(ccn1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C18H18F6N4O3S/c19-17(20,21)16(29,18(22,23)24)12-1-3-13(4-2-12)27-7-9-28(10-8-27)32(30,31)14-5-6-26-15(25)11-14/h1-6,11,29H,7-10H2,(H2,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 8630.0n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of fluorescein-labeled human GK interaction with biotin-labeled human GKRP incubated for 20 mins prior to addition of fluorescein-labeled ...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
CHEMBL1091356
PNG
(1-(4-(4-(3-oxa-8-azabicyclo[3.2.1]octan-8-yl)-6-(t...)
Show SMILES CC(C)N1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
Show InChI InChI=1S/C35H44N8O4/c1-23(2)41-15-17-42(18-16-41)33(44)26-5-9-28(10-6-26)37-35(45)36-27-7-3-24(4-8-27)31-38-32(25-13-19-46-20-14-25)40-34(39-31)43-29-11-12-30(43)22-47-21-29/h3-10,23,25,29-30H,11-22H2,1-2H3,(H2,36,37,45)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
ZINC 0

Similars

AffyNet 
Article
PubMed
n/an/a<50000.0n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of GCK


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens)
CHEMBL1095626
PNG
(methyl 4-(6-(4-aminophenyl)-4-morpholino-1H-pyrazo...)
Show SMILES COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(N)cc1)N1CCOCC1
Show InChI InChI=1S/C22H27N7O3/c1-31-22(30)28-8-6-17(7-9-28)29-21-18(14-24-29)20(27-10-12-32-13-11-27)25-19(26-21)15-2-4-16(23)5-3-15/h2-5,14,17H,6-13,23H2,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
ZINC 0

Similars

AffyNet 
Article
PubMed
n/an/a>50000.0n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of GCK


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens)
CHEMBL1095627
PNG
(tert-Butyl 4-(6-(4-aminophenyl)-4-morpholino-1H-py...)
Show SMILES CC(C)(C)OC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(N)cc1)N1CCOCC1
Show InChI InChI=1S/C25H33N7O3/c1-25(2,3)35-24(33)31-10-8-19(9-11-31)32-23-20(16-27-32)22(30-12-14-34-15-13-30)28-21(29-23)17-4-6-18(26)7-5-17/h4-7,16,19H,8-15,26H2,1-3H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
ZINC 0

Similars

AffyNet 
Article
PubMed
n/an/a>50000.0n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of GCK


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens)
CHEMBL1080995
PNG
(6-methyl-4-(4-methyl-1H-indol-5-ylamino)-5-(3-(4-m...)
Show SMILES CN1CCN(CC1)S(=O)(=O)c1cccc(\C=C\c2c(C)ncc(C#N)c2Nc2ccc3[nH]ccc3c2C)c1
Show InChI InChI=1S/C29H30N6O2S/c1-20-25-11-12-31-28(25)10-9-27(20)33-29-23(18-30)19-32-21(2)26(29)8-7-22-5-4-6-24(17-22)38(36,37)35-15-13-34(3)14-16-35/h4-12,17,19,31H,13-16H2,1-3H3,(H,32,33)/b8-7+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
ZINC 0

Similars

AffyNet 
Article
PubMed
n/an/a>50000.0n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of GCK


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens)
CHEMBL1089082
PNG
(N-(3-(2-(pyridin-4-yl)pyrazolo[1,5-a]pyrimidin-7-y...)
Show SMILES FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(c1)-c1ccnc2cc(nn12)-c1ccncc1
Show InChI InChI=1S/C25H16F3N5O/c26-25(27,28)19-5-1-4-18(13-19)24(34)31-20-6-2-3-17(14-20)22-9-12-30-23-15-21(32-33(22)23)16-7-10-29-11-8-16/h1-15H,(H,31,34)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
ZINC 0

Similars

AffyNet 
Article
PubMed
n/an/a>50000.0n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of GCK


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens)
CHEMBL1092754
PNG
(4-(3-((4-hydroxy-3-oxobenzofuran-2(3H)-ylidene)met...)
Show SMILES Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)-c1ccc(cc1)C(=O)NCCO
Show InChI InChI=1S/C26H21N3O5/c1-29-14-17(13-21-24(32)23-19(31)3-2-4-20(23)34-21)22-18(9-10-27-25(22)29)15-5-7-16(8-6-15)26(33)28-11-12-30/h2-10,13-14,30-31H,11-12H2,1H3,(H,28,33)/b21-13-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
ZINC 0

Similars

AffyNet 
Article
PubMed
n/an/a 50000.0n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of GCK


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
benzamide derivative, 13m
PNG
Show SMILES Nc1cc(F)c(Sc2nccs2)cc1C(=O)Nc1cccc(c1)C#N
Show InChI InChI=1S/C17H11FN4OS2/c18-13-8-14(20)12(7-15(13)25-17-21-4-5-24-17)16(23)22-11-3-1-2-10(6-11)9-19/h1-8H,20H2,(H,22,23)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
ZINC 0

Similars

AffyNet 
Article
PubMed
n/an/an/an/an/an/an/a7.423



Shanghai Institutes for Biological Sciences



Assay Description
The GK activity was assessed spectrometrically by a coupled reaction with glucose-6-phosphate dehydrogenase (G6PDH). Briefly, GK catalyzes glucose ph...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
benzamide derivative, 13n
PNG
Show SMILES Cc1csc(Sc2cc(C(=O)Nc3cccc(c3)C#N)c(N)cc2F)n1
Show InChI InChI=1S/C18H13FN4OS2/c1-10-9-25-18(22-10)26-16-6-13(15(21)7-14(16)19)17(24)23-12-4-2-3-11(5-12)8-20/h2-7,9H,21H2,1H3,(H,23,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
ZINC 0

Similars

AffyNet 
Article
PubMed
n/an/an/an/an/an/an/a7.423



Shanghai Institutes for Biological Sciences



Assay Description
The GK activity was assessed spectrometrically by a coupled reaction with glucose-6-phosphate dehydrogenase (G6PDH). Briefly, GK catalyzes glucose ph...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
benzamide derivative, 13v
PNG
Show SMILES COc1ccc(NC(=O)c2cc(Sc3nccn3C)c(F)cc2N)cc1
Show InChI InChI=1S/C18H17FN4O2S/c1-23-8-7-21-18(23)26-16-9-13(15(20)10-14(16)19)17(24)22-11-3-5-12(25-2)6-4-11/h3-10H,20H2,1-2H3,(H,22,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
ZINC 0

Similars

AffyNet 
Article
PubMed
n/an/an/an/a 1360n/an/a7.423



Shanghai Institutes for Biological Sciences



Assay Description
The GK activity was assessed spectrometrically by a coupled reaction with glucose-6-phosphate dehydrogenase (G6PDH). Briefly, GK catalyzes glucose ph...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
benzamide derivative, 13w
PNG
Show SMILES COc1cccc(NC(=O)c2cc(Sc3nccn3C)c(F)cc2N)c1
Show InChI InChI=1S/C18H17FN4O2S/c1-23-7-6-21-18(23)26-16-9-13(15(20)10-14(16)19)17(24)22-11-4-3-5-12(8-11)25-2/h3-10H,20H2,1-2H3,(H,22,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
ZINC 0

Similars

AffyNet 
Article
PubMed
n/an/an/an/an/an/an/a7.423



Shanghai Institutes for Biological Sciences



Assay Description
The GK activity was assessed spectrometrically by a coupled reaction with glucose-6-phosphate dehydrogenase (G6PDH). Briefly, GK catalyzes glucose ph...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
benzamide derivative, 13x
PNG
Show SMILES COc1ccc(NC(=O)c2cc(Sc3nccn3C)c(F)cc2N)cc1OC
Show InChI InChI=1S/C19H19FN4O3S/c1-24-7-6-22-19(24)28-17-9-12(14(21)10-13(17)20)18(25)23-11-4-5-15(26-2)16(8-11)27-3/h4-10H,21H2,1-3H3,(H,23,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
ZINC 0

Similars

AffyNet 
Article
PubMed
n/an/an/an/an/an/an/a7.423



Shanghai Institutes for Biological Sciences



Assay Description
The GK activity was assessed spectrometrically by a coupled reaction with glucose-6-phosphate dehydrogenase (G6PDH). Briefly, GK catalyzes glucose ph...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
benzamide derivative, 14a
PNG
Show SMILES Nc1cccc(NC(=O)CN2CCN(CC2)c2ccccc2F)c1
Show InChI InChI=1S/C18H21FN4O/c19-16-6-1-2-7-17(16)23-10-8-22(9-11-23)13-18(24)21-15-5-3-4-14(20)12-15/h1-7,12H,8-11,13,20H2,(H,21,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
ZINC 0

Similars

AffyNet 
Article
PubMed
n/an/an/an/an/an/an/a7.423



Shanghai Institutes for Biological Sciences



Assay Description
The GK activity was assessed spectrometrically by a coupled reaction with glucose-6-phosphate dehydrogenase (G6PDH). Briefly, GK catalyzes glucose ph...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
benzamide derivative, 14b
PNG
Show SMILES Fc1ccccc1N1CCN(CC(=O)Nc2cccc(c2)C(F)(F)F)CC1
Show InChI InChI=1S/C19H19F4N3O/c20-16-6-1-2-7-17(16)26-10-8-25(9-11-26)13-18(27)24-15-5-3-4-14(12-15)19(21,22)23/h1-7,12H,8-11,13H2,(H,24,27)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
ZINC 0

Similars

AffyNet 
Article
PubMed
n/an/an/an/an/an/an/a7.423



Shanghai Institutes for Biological Sciences



Assay Description
The GK activity was assessed spectrometrically by a coupled reaction with glucose-6-phosphate dehydrogenase (G6PDH). Briefly, GK catalyzes glucose ph...


Citation and Details
More data for this
Ligand-Target Pair
Glucokinase


(Homo sapiens (Human))
benzamide derivative, 14c
PNG
Show SMILES Fc1cccc(NC(=O)CN2CCN(CC2)c2ccccc2F)c1
Show InChI InChI=1S/C18H19F2N3O/c19-14-4-3-5-15(12-14)21-18(24)13-22-8-10-23(11-9-22)17-7-2-1-6-16(17)20/h1-7,12H,8-11,13H2,(H,21,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
Antibodypedia

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
ZINC 0

Similars

AffyNet 
Article
PubMed
n/an/an/an/an/an/an/a7.423



Shanghai Institutes for Biological Sciences



Assay Description
The GK activity was assessed spectrometrically by a coupled reaction with glucose-6-phosphate dehydrogenase (G6PDH). Briefly, GK catalyzes glucose ph...


Citation and Details
More data for this
Ligand-Target Pair
Displayed 1 to 50 (of 749 total )  |  Next  |  Last  >>
Jump to: