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PDB code 3I7G

Compile Data Set for Download or QSAR

Identical Ligands in BindingDB

Found 1 hit Enzyme Inhibition Constant Data   
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
Collagenase 3

  (171/171 = 100%)
(Homo sapiens (Human))
BDBM32395
PNG
(furan-2-carboxamide deriv., 1)
Show SMILES CNC(=O)[C@@H](NC(=O)c1ccc(o1)-c1ccc(Cl)cc1)C1CCCCC1 |r|
Show InChI InChI=1S/C20H23ClN2O3/c1-22-20(25)18(14-5-3-2-4-6-14)23-19(24)17-12-11-16(26-17)13-7-9-15(21)10-8-13/h7-12,14,18H,2-6H2,1H3,(H,22,25)(H,23,24)/t18-/m0/s1
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Article
PubMed
n/an/a 430n/an/an/an/a7.537



Boehringer Ingelheim Pharmaceuticals



Assay Description
MMP-13 was assessed by using the EnzoLyte 520 Generic MMP Assay Kit (AnaSpec Inc.). This kit uses a 5-FAM/QXL 520 fluorescence resonance 10 energy tr...


Bioorg Med Chem Lett 19: 5321-4 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.151
BindingDB Entry DOI: 10.7270/Q22B8WCD
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)

Search BindingMOAD for More Affinity Data:

* indicates data uncertainty>20%
* 0.9 Tanimoto similarity
Identities from BLAST output