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BDBM50325364 (R)-N-(3-(5-(1-cyclohexyl-2-(methylamino)-2-oxoethylcarbamoyl)furan-2-yl)benzyl)imidazo[1,2-a]pyridine-2-carboxamide::CHEMBL1222988

SMILES: CNC(=O)[C@H](NC(=O)c1ccc(o1)-c1cccc(CNC(=O)c2cn3ccccc3n2)c1)C1CCCCC1

InChI Key: InChIKey=QRMOUDIUZGKDLX-AREMUKBSSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50325364   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Collagenase 3


(Homo sapiens (Human))
BDBM50325364
PNG
((R)-N-(3-(5-(1-cyclohexyl-2-(methylamino)-2-oxoeth...)
Show SMILES CNC(=O)[C@H](NC(=O)c1ccc(o1)-c1cccc(CNC(=O)c2cn3ccccc3n2)c1)C1CCCCC1 |r|
Show InChI InChI=1S/C29H31N5O4/c1-30-29(37)26(20-9-3-2-4-10-20)33-28(36)24-14-13-23(38-24)21-11-7-8-19(16-21)17-31-27(35)22-18-34-15-6-5-12-25(34)32-22/h5-8,11-16,18,20,26H,2-4,9-10,17H2,1H3,(H,30,37)(H,31,35)(H,33,36)/t26-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 100n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of MMP13


Bioorg Med Chem Lett 20: 5039-43 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.036
BindingDB Entry DOI: 10.7270/Q28S4Q3K
More data for this
Ligand-Target Pair