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Target
Metalloproteinase inhibitor 3
Ligand
BDBM50073898
Substrate
n/a
Meas. Tech.
ChEBML_104705
IC50
187±n/a nM
Citation
 Fink, CA; Carlson, JE; Boehm, C; McTaggart, P; Qiao, Y; Doughty, J; Ganu, V; Melton, R; Goldberg, R Design and synthesis of thiol containing inhibitors of matrix metalloproteinases. Bioorg Med Chem Lett 9:195-200 (1999) [PubMed]  Article 
Target
Name:
Metalloproteinase inhibitor 3
Synonyms:
TIMP3_RAT | Timp-3 | Timp3 | Tissue inhibitor of metalloproteinases 3 | Tissue inhibitor of metalloproteinases-3
Type:
PROTEIN
Mol. Mass.:
24241.51
Organism:
Rattus norvegicus
Description:
ChEMBL_10750
Residue:
211
Sequence:
MTPWLGLVVLLSCWSLGHWGTEACTCSPSHPQDAFCNSDIVIRAKVVGKKLVKEGPFGTLVYTIKQMKMYRGFSKMPHVQYIHTEASESLCGLKLEVNKYQYLLTGRVYEGKMYTGLCNFVERWDHLTLSQRKGLNYRYHLGCNCKIKSCYYLPCFVTSKKECLWTDMLSNFGYPGYQSKHYACIRQKGGYCSWYRGWAPPDKSISNATDP
  
Inhibitor
Name:
BDBM50073898
Synonyms:
1-Mercaptomethyl-4-propoxy-cyclohexanecarboxylic acid ((S)-1-methylcarbamoyl-2-phenyl-ethyl)-amide | CHEMBL292115
Type:
Small organic molecule
Emp. Form.:
C21H32N2O3S
Mol. Mass.:
392.555
SMILES:
CCCO[C@H]1CC[C@](CS)(CC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC |wU:7.12,15.15,4.3,wD:7.7,(-9.2,-11.82,;-7.86,-11.05,;-7.86,-9.51,;-6.53,-8.76,;-6.53,-7.22,;-7.85,-6.45,;-7.85,-4.91,;-6.53,-4.14,;-7.86,-3.37,;-7.86,-1.83,;-5.19,-4.91,;-5.19,-6.45,;-5.19,-3.37,;-5.19,-1.83,;-3.85,-4.14,;-2.52,-3.37,;-2.52,-1.83,;-1.76,-.48,;-.22,-.46,;.52,.89,;-.28,2.21,;-1.82,2.18,;-2.56,.83,;-1.19,-4.14,;-1.19,-5.68,;.14,-3.37,;.14,-1.83,)|
Structure:
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