Target
Cathepsin S
Ligand
BDBM50323261
Substrate
n/a
Meas. Tech.
ChEMBL_643889 (CHEMBL1211788)
IC50
27±n/a nM
Citation
 Cai, JBaugh, MBlack, DLong, CJonathan Bennett, DDempster, MFradera, XGillespie, JAndrews, FBoucharens, SBruin, JCameron, KSCumming, IHamilton, WJones, PSKaptein, AKinghorn, EMaidment, MMartin, IMitchell, ARankovic, ZRobinson, JScullion, PUitdehaag, JCVink, PWestwood, Pvan Zeeland, Mvan Berkom, LBastiani, MMeulemans, T 6-Phenyl-1H-imidazo[4,5-c]pyridine-4-carbonitrile as cathepsin S inhibitors. Bioorg Med Chem Lett 20:4350-4 (2010) [PubMed]  Article 
Target
Name:
Cathepsin S
Synonyms:
CATS_HUMAN | CTSS | Cathepsin S (Cat S) | cathepsin S preproprotein
Type:
Protein
Mol. Mass.:
37507.38
Organism:
Homo sapiens (Human)
Description:
P25774
Residue:
331
Sequence:
MKRLVCVLLVCSSAVAQLHKDPTLDHHWHLWKKTYGKQYKEKNEEAVRRLIWEKNLKFVMLHNLEHSMGMHSYDLGMNHLGDMTSEEVMSLMSSLRVPSQWQRNITYKSNPNRILPDSVDWREKGCVTEVKYQGSCGACWAFSAVGALEAQLKLKTGKLVSLSAQNLVDCSTEKYGNKGCNGGFMTTAFQYIIDNKGIDSDASYPYKAMDQKCQYDSKYRAATCSKYTELPYGREDVLKEAVANKGPVSVGVDARHPSFFLYRSGVYYEPSCTQNVNHGVLVVGYGDLNGKEYWLVKNSWGHNFGEEGYIRMARNKGNHCGIASFPSYPEI
  
Inhibitor
Name:
BDBM50323261
Synonyms:
1-(3-(dimethylamino)propyl)-6-(4-ethoxy-3-(trifluoromethyl)phenyl)-1H-imidazo[4,5-c]pyridine-4-carbonitrile | CHEMBL1208907
Type:
Small organic molecule
Emp. Form.:
C21H22F3N5O
Mol. Mass.:
417.4275
SMILES:
CCOc1ccc(cc1C(F)(F)F)-c1cc2n(CCCN(C)C)cnc2c(n1)C#N
Structure:
Search PDB for entries with ligand similarity: