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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Chymase' and Ligand = 'BDBM50093750'   
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
Chymase


(Homo sapiens (Human))
BDBM50093750
PNG
((6R,7R)-3-(1-Carboxymethyl-1H-tetrazol-5-ylsulfany...)
Show SMILES COc1ccccc1C(=O)N[C@@]1(OC)[C@H]2OCC(CSc3nnnn3CC(O)=O)=C(N2C1=O)C(=O)OCc1cccc(C)c1
Show InChI InChI=1S/C28H28N6O9S/c1-16-7-6-8-17(11-16)13-42-24(38)22-18(15-44-27-30-31-32-33(27)12-21(35)36)14-43-26-28(41-3,25(39)34(22)26)29-23(37)19-9-4-5-10-20(19)40-2/h4-11,26H,12-15H2,1-3H3,(H,29,37)(H,35,36)/t26-,28+/m1/s1
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Similars

Article
PubMed
n/an/a 6n/an/an/an/an/an/a



Shionogi & Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human Serine protease chymase


Bioorg Med Chem Lett 10: 2403-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00489-3
BindingDB Entry DOI: 10.7270/Q23R0S4F
More data for this
Ligand-Target Pair