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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Matrix metalloproteinase-9' and Ligand = 'BDBM50107576'   
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
Matrix metalloproteinase-9


(Homo sapiens (Human))
BDBM50107576
PNG
((R)-N*4*-Hydroxy-N*1*-((1S,2R)-2-hydroxy-indan-1-y...)
Show SMILES Cc1cccc(c1)-c1ccc(C[C@H](CC(=O)NO)C(=O)N[C@@H]2[C@H](O)Cc3ccccc23)cc1
Show InChI InChI=1S/C27H28N2O4/c1-17-5-4-7-20(13-17)19-11-9-18(10-12-19)14-22(16-25(31)29-33)27(32)28-26-23-8-3-2-6-21(23)15-24(26)30/h2-13,22,24,26,30,33H,14-16H2,1H3,(H,28,32)(H,29,31)/t22-,24-,26+/m1/s1
PDB
MMDB

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Similars

PubMed
1.09E+3n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Pharma Company

Curated by ChEMBL


Assay Description
Binding affinity for human gelatinase B (MMP-9)


Bioorg Med Chem Lett 12: 101-4 (2001)


BindingDB Entry DOI: 10.7270/Q2R49Q1C
More data for this
Ligand-Target Pair