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2 similar compounds to monomer 50310309

Wt: 403.4
BDBM50310308
Wt: 443.4
BDBM50310311

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50310308,50310311   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Plasminogen activator inhibitor-1


(Homo sapiens (Human))
BDBM50310308
PNG
(CHEMBL597478 | N-(3,4-dihydroxyphenylsulfonyl)-3,4...)
Show SMILES CCCN(S(=O)(=O)c1ccc(O)c(O)c1)S(=O)(=O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C15H17NO8S2/c1-2-7-16(25(21,22)10-3-5-12(17)14(19)8-10)26(23,24)11-4-6-13(18)15(20)9-11/h3-6,8-9,17-20H,2,7H2,1H3
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MMDB

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Article
PubMed
n/an/a 2.67E+3n/an/an/an/an/an/a



Eastern Michigan University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PAI1 assessed as rate of AMC release after 30 mins


Bioorg Med Chem Lett 20: 966-70 (2010)

More data for this
Ligand-Target Pair
Coagulation factor X/antithrombin III


(Homo sapiens)
BDBM50310311
PNG
(CHEMBL601265 | N-cyclohexyl-N-(3,4-dihydroxyphenyl...)
Show SMILES Oc1ccc(cc1O)S(=O)(=O)N(C1CCCCC1)S(=O)(=O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C18H21NO8S2/c20-15-8-6-13(10-17(15)22)28(24,25)19(12-4-2-1-3-5-12)29(26,27)14-7-9-16(21)18(23)11-14/h6-12,20-23H,1-5H2
PDB
MMDB

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Article
PubMed
n/an/a>3.00E+5n/an/an/an/an/an/a



Eastern Michigan University

Curated by ChEMBL


Assay Description
Inhibition of antithrombin-3 assessed as residual alpha-thrombin activity


Bioorg Med Chem Lett 20: 966-70 (2010)

More data for this
Ligand-Target Pair
Coagulation factor X/antithrombin III


(Homo sapiens)
BDBM50310308
PNG
(CHEMBL597478 | N-(3,4-dihydroxyphenylsulfonyl)-3,4...)
Show SMILES CCCN(S(=O)(=O)c1ccc(O)c(O)c1)S(=O)(=O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C15H17NO8S2/c1-2-7-16(25(21,22)10-3-5-12(17)14(19)8-10)26(23,24)11-4-6-13(18)15(20)9-11/h3-6,8-9,17-20H,2,7H2,1H3
PDB
MMDB

NCI pathway
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UniChem

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Article
PubMed
n/an/a>1.00E+6n/an/an/an/an/an/a



Eastern Michigan University

Curated by ChEMBL


Assay Description
Inhibition of antithrombin-3 assessed as residual alpha-thrombin activity


Bioorg Med Chem Lett 20: 966-70 (2010)

More data for this
Ligand-Target Pair
Plasminogen activator inhibitor-1


(Homo sapiens (Human))
BDBM50310311
PNG
(CHEMBL601265 | N-cyclohexyl-N-(3,4-dihydroxyphenyl...)
Show SMILES Oc1ccc(cc1O)S(=O)(=O)N(C1CCCCC1)S(=O)(=O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C18H21NO8S2/c20-15-8-6-13(10-17(15)22)28(24,25)19(12-4-2-1-3-5-12)29(26,27)14-7-9-16(21)18(23)11-14/h6-12,20-23H,1-5H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents


Similars

Article
PubMed
n/an/a 594n/an/an/an/an/an/a



Eastern Michigan University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PAI1 assessed as rate of AMC release after 30 mins


Bioorg Med Chem Lett 20: 966-70 (2010)

More data for this
Ligand-Target Pair