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Target
Metalloproteinase inhibitor 3
Ligand
BDBM50073903
Substrate
n/a
Meas. Tech.
ChEBML_104705
IC50
926±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:
BDBM50073903
Synonyms:
1-Mercaptomethyl-4-methoxy-cyclohexanecarboxylic acid ((S)-1-methylcarbamoyl-2-phenyl-ethyl)-amide | CHEMBL294088
Type:
Small organic molecule
Emp. Form.:
C19H28N2O3S
Mol. Mass.:
364.502
SMILES:
CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@]1(CS)CC[C@@H](CC1)OC |wU:15.15,4.12,20.24,wD:15.16,(3.19,-.33,;3.19,-1.87,;1.86,-2.64,;1.86,-4.18,;.52,-1.87,;.52,-.33,;1.28,1.02,;2.82,1.03,;3.57,2.37,;2.77,3.71,;1.23,3.68,;.49,2.33,;-.8,-2.64,;-2.14,-1.87,;-2.14,-.33,;-3.49,-2.64,;-4.81,-1.87,;-4.81,-.33,;-4.8,-3.41,;-4.8,-4.95,;-3.49,-5.72,;-2.14,-4.95,;-2.14,-3.41,;-3.49,-7.26,;-4.81,-8.02,)|
Structure:
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