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TargetCathepsin S
LigandBDBM50223939
Substrate/Competitorn/a
Meas. Tech.ChEMBL_458258 (CHEMBL924504)
IC50 820±n/a nM
Citation Teno, NMiyake, TEhara, TIrie, OSakaki, JOhmori, OGunji, HMatsuura, NMasuya, KHitomi, YNonomura, KHoriuchi, MGohda, KIwasaki, AUmemura, ITada, SKometani, MIwasaki, GCowan-Jacob, SWMissbach, MLattmann, RBetschart, C Novel scaffold for cathepsin K inhibitors. Bioorg Med Chem Lett17:6096-100 (2007) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Cathepsin S
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:
MKRLVCVLLVCSSAVAQLHKDPTLDHHWHLWKKTYGKQYKEKNEEAVRRLIWEKNLKFVM
LHNLEHSMGMHSYDLGMNHLGDMTSEEVMSLMSSLRVPSQWQRNITYKSNPNRILPDSVD
WREKGCVTEVKYQGSCGACWAFSAVGALEAQLKLKTGKLVSLSAQNLVDCSTEKYGNKGC
NGGFMTTAFQYIIDNKGIDSDASYPYKAMDQKCQYDSKYRAATCSKYTELPYGREDVLKE
AVANKGPVSVGVDARHPSFFLYRSGVYYEPSCTQNVNHGVLVVGYGDLNGKEYWLVKNSW
GHNFGEEGYIRMARNKGNHCGIASFPSYPEI
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50223939
n/a
NameBDBM50223939
Synonyms:6-(4-methoxybenzyl)-7-neopentyl-7H-pyrrolo[2,3-d]pyrimidine-2-carbonitrile | CHEMBL250590
TypeSmall organic molecule
Emp. Form.C20H22N4O
Mol. Mass.334.4149
SMILESCOc1ccc(Cc2cc3cnc(nc3n2CC(C)(C)C)C#N)cc1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: