BDBM50215989 CHEMBL392232::cis-N-(1-methyl-4-(5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)piperidin-3-yl)-4-((2-methylquinolin-4-yl)methoxy)benzamide

SMILES CN1CC[C@@H]([C@@H](C1)NC(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1)c1n[nH]c(=S)[nH]1

InChI Key InChIKey=HOQRRVLBMMILPN-UHFFFAOYSA-N

Data  5 KI  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50215989   

TargetDisintegrin and metalloproteinase domain-containing protein 17(Pig)
Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL
LigandPNGBDBM50215989(cis-N-(1-methyl-4-(5-thioxo-4,5-dihydro-1H-1,2,4-t...)
Affinity DataIC50: 16nMAssay Description:Inhibition of porcine TACEMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetMacrophage metalloelastase(Human)
Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL
LigandPNGBDBM50215989(cis-N-(1-methyl-4-(5-thioxo-4,5-dihydro-1H-1,2,4-t...)
Affinity DataKi:  958nMAssay Description:Inhibition of MMP12More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target72 kDa type IV collagenase(Human)
Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL
LigandPNGBDBM50215989(cis-N-(1-methyl-4-(5-thioxo-4,5-dihydro-1H-1,2,4-t...)
Affinity DataKi: >3.33E+3nMAssay Description:Inhibition of MMP2More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetStromelysin-1(Human)
Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL
LigandPNGBDBM50215989(cis-N-(1-methyl-4-(5-thioxo-4,5-dihydro-1H-1,2,4-t...)
Affinity DataKi: >4.50E+3nMAssay Description:Inhibition of MMP3More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCollagenase 3(Human)
Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL
LigandPNGBDBM50215989(cis-N-(1-methyl-4-(5-thioxo-4,5-dihydro-1H-1,2,4-t...)
Affinity DataKi: >5.03E+3nMAssay Description:Inhibition of MMP13More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetMatrilysin(Human)
Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL
LigandPNGBDBM50215989(cis-N-(1-methyl-4-(5-thioxo-4,5-dihydro-1H-1,2,4-t...)
Affinity DataKi:  5.37E+3nMAssay Description:Inhibition of MMP7More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed