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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Interstitial collagenase' and Ligand = 'BDBM50105438'   
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
Interstitial collagenase


(Homo sapiens (Human))
BDBM50105438
PNG
(CHEMBL328792 | [(S)-1-Hydroxycarbamoyl-2-(4-phenox...)
Show SMILES CN([C@H](CS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO)C(=O)OC(C)(C)C
Show InChI InChI=1S/C21H26N2O7S/c1-21(2,3)30-20(25)23(4)18(19(24)22-26)14-31(27,28)17-12-10-16(11-13-17)29-15-8-6-5-7-9-15/h5-13,18,26H,14H2,1-4H3,(H,22,24)/t18-/m1/s1
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MMDB

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PubMed
n/an/a 1.60E+6n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloproteinase-1


Bioorg Med Chem Lett 11: 2719-22 (2001)


BindingDB Entry DOI: 10.7270/Q2TD9WNW
More data for this
Ligand-Target Pair