BindingDB logo
myBDB logout

PubMed code 8410982

Compile data set for download or QSAR
Found 5 hits of Enzyme Inhibition Constant Data   
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
Human immunodeficiency virus type 1 Tat protein


(Human immunodeficiency virus type 1 (isolate PCV12...)
BDBM50045400
PNG
(Acetic acid 2-methanesulfonyl-10,13-dimethyl-3-oxo...)
Show SMILES CC(=O)O[C@H]1CC[C@H]2[C@@H]3CC[C@]45OC4C(=O)C(C[C@]5(C)[C@H]3CC[C@]12C)S(C)(=O)=O
Show InChI InChI=1S/C22H32O6S/c1-12(23)27-17-6-5-14-13-7-10-22-19(28-22)18(24)16(29(4,25)26)11-21(22,3)15(13)8-9-20(14,17)2/h13-17,19H,5-11H2,1-4H3/t13-,14-,15-,16?,17-,19?,20-,21+,22-/m0/s1
PDB
MMDB

Reactome pathway

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.60E+3n/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Inhibition of HIV-1 nuclear regulatory protein Tat


J Med Chem 36: 2701-2 (1993)


Article DOI: 10.1021/jm00070a014
BindingDB Entry DOI: 10.7270/Q2NG4PP3
More data for this
Ligand-Target Pair
Human immunodeficiency virus type 1 Tat protein


(Human immunodeficiency virus type 1 (isolate PCV12...)
BDBM50045403
PNG
(Acetic acid 2-carbamoyl-3-hydroxy-10,13-dimethyl-1...)
Show SMILES CC(=O)O[C@H]1CCC2C3CC[C@]45O[C@H]4C(O)=C(C[C@]5(C)C3CC[C@]12C)C(N)=O
Show InChI InChI=1S/C22H31NO5/c1-11(24)27-16-5-4-14-12-6-9-22-18(28-22)17(25)13(19(23)26)10-21(22,3)15(12)7-8-20(14,16)2/h12,14-16,18,25H,4-10H2,1-3H3,(H2,23,26)/t12?,14?,15?,16-,18-,20-,21+,22-/m0/s1
PDB
MMDB

Reactome pathway

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.60E+3n/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Inhibition of HIV-1 nuclear regulatory protein Tat


J Med Chem 36: 2701-2 (1993)


Article DOI: 10.1021/jm00070a014
BindingDB Entry DOI: 10.7270/Q2NG4PP3
More data for this
Ligand-Target Pair
Human immunodeficiency virus type 1 Tat protein


(Human immunodeficiency virus type 1 (isolate PCV12...)
BDBM50032828
PNG
(7-Chloro-5-(1H-pyrrol-2-yl)-1,3-dihydro-benzo[e][1...)
Show SMILES Clc1ccc2NC(=O)CN=C(c3ccc[nH]3)c2c1
Show InChI InChI=1S/C13H10ClN3O/c14-8-3-4-10-9(6-8)13(11-2-1-5-15-11)16-7-12(18)17-10/h1-6,15H,7H2,(H,17,18)
PDB
MMDB

Reactome pathway

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 4.00E+3n/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Inhibition of HIV-1 nuclear regulatory protein Tat


J Med Chem 36: 2701-2 (1993)


Article DOI: 10.1021/jm00070a014
BindingDB Entry DOI: 10.7270/Q2NG4PP3
More data for this
Ligand-Target Pair
Human immunodeficiency virus type 1 Tat protein


(Human immunodeficiency virus type 1 (isolate PCV12...)
BDBM50045401
PNG
(17-Hydroxy-2-methanesulfonyl-10,13-dimethyl-tetrad...)
Show SMILES C[C@]12CC[C@H]3[C@@H](CC[C@]45OC4C(=O)C(C[C@]35C)S(C)(=O)=O)[C@@H]1CC[C@@H]2O
Show InChI InChI=1S/C20H30O5S/c1-18-8-7-13-11(12(18)4-5-15(18)21)6-9-20-17(25-20)16(22)14(26(3,23)24)10-19(13,20)2/h11-15,17,21H,4-10H2,1-3H3/t11-,12-,13-,14?,15-,17?,18-,19+,20-/m0/s1
PDB
MMDB

Reactome pathway

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8.40E+3n/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Inhibition of HIV-1 nuclear regulatory protein Tat


J Med Chem 36: 2701-2 (1993)


Article DOI: 10.1021/jm00070a014
BindingDB Entry DOI: 10.7270/Q2NG4PP3
More data for this
Ligand-Target Pair
Human immunodeficiency virus type 1 Tat protein


(Human immunodeficiency virus type 1 (isolate PCV12...)
BDBM50045402
PNG
(3,17-Dihydroxy-10,13-dimethyl-1,4,6,7,8,9,10,11,12...)
Show SMILES C[C@]12CCC3C(CC[C@]45OC4C(=O)C(C[C@]35C)C(N)=O)C1CC[C@@H]2O
Show InChI InChI=1S/C20H29NO4/c1-18-7-6-13-10(12(18)3-4-14(18)22)5-8-20-16(25-20)15(23)11(17(21)24)9-19(13,20)2/h10-14,16,22H,3-9H2,1-2H3,(H2,21,24)/t10?,11?,12?,13?,14-,16?,18-,19+,20-/m0/s1
PDB
MMDB

Reactome pathway

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.43E+4n/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Inhibition of HIV-1 nuclear regulatory protein Tat


J Med Chem 36: 2701-2 (1993)


Article DOI: 10.1021/jm00070a014
BindingDB Entry DOI: 10.7270/Q2NG4PP3
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%