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Target
Metalloproteinase inhibitor 3
Ligand
BDBM50073896
Substrate
n/a
Meas. Tech.
ChEBML_104705
IC50
>10000±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:
BDBM50073896
Synonyms:
1-Mercaptomethyl-4-propyl-cyclohexanecarboxylic acid ((S)-1-methylcarbamoyl-2-phenyl-ethyl)-amide | CHEMBL60431
Type:
Small organic molecule
Emp. Form.:
C21H32N2O2S
Mol. Mass.:
376.556
SMILES:
CCC[C@H]1CC[C@](CS)(CC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC |wU:6.11,14.14,3.2,wD:6.6,(-1.76,-12.48,;-1.76,-10.92,;-.44,-10.18,;-.44,-8.64,;-1.75,-7.87,;-1.75,-6.33,;-.44,-5.56,;-1.76,-4.79,;-1.76,-3.25,;.91,-6.33,;.91,-7.87,;.91,-4.79,;.91,-3.25,;2.25,-5.56,;3.57,-4.79,;3.57,-3.25,;4.33,-1.9,;3.54,-.59,;4.28,.76,;5.82,.79,;6.62,-.55,;5.87,-1.89,;4.91,-5.56,;4.91,-7.1,;6.23,-4.79,;6.23,-3.25,)|
Structure:
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