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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Chymase' and Ligand = 'BDBM50068892'   
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))		BDBM50068892
PNG
(3-(4-{[(S)-1-((S)-2-Acetylamino-3-methyl-butyryl)-...)
Show SMILES CC(C)[C@H](NC(C)=O)C(=O)N1CCC[C@H]1C(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)Nc1cccc(c1)C(O)=O
Show InChI InChI=1S/C30H34F2N4O7/c1-17(2)24(33-18(3)37)27(40)36-14-8-13-23(36)26(39)35-22(15-19-9-5-4-6-10-19)25(38)30(31,32)29(43)34-21-12-7-11-20(16-21)28(41)42/h4-7,9-12,16-17,22-24H,8,13-15H2,1-3H3,(H,33,37)(H,34,43)(H,35,39)(H,41,42)/t22?,23-,24-/m0/s1
PDB
MMDB

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PubMed
 7.10n/an/an/an/an/an/an/an/a



Green Cross Research Laboratories

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibitory activity against human heart chymase (HHC)

Bioorg Med Chem Lett 8: 913-8 (1999)


BindingDB Entry DOI: 10.7270/Q2GQ6WXB
More data for this
Ligand-Target Pair