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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Stromelysin-1' and Ligand = 'BDBM50282554'   
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
Stromelysin-1


(Homo sapiens (Human))		BDBM50282554
PNG
(((R)-1-{(S)-2-[(1-Acetyl-pyrrolidine-2-carbonyl)-a...)
Show SMILES CC(C)C[C@H](NC(=O)C(CCc1ccccc1)CP(O)(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C1CCCN1C(C)=O)C(=O)Nc1ccccc1
Show InChI InChI=1S/C35H50N5O7P/c1-23(2)21-30(34(44)38-29-15-10-7-11-16-29)39-33(43)28(19-18-27-13-8-6-9-14-27)22-48(46,47)25(4)37-32(42)24(3)36-35(45)31-17-12-20-40(31)26(5)41/h6-11,13-16,23-25,28,30-31H,12,17-22H2,1-5H3,(H,36,45)(H,37,42)(H,38,44)(H,39,43)(H,46,47)/t24-,25+,28?,30-,31?/m0/s1
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Similars
Article
 6.10n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of human recombinant stromelysin-1.

Bioorg Med Chem Lett 4: 1221-1224 (1994)


Article DOI: 10.1016/S0960-894X(01)80334-6
BindingDB Entry DOI: 10.7270/Q2125SM3
More data for this
Ligand-Target Pair