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Target
Metalloproteinase inhibitor 3
Ligand
BDBM50073893
Substrate
n/a
Meas. Tech.
ChEBML_104705
IC50
49±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:
BDBM50073893
Synonyms:
4-Ethoxy-1-mercaptomethyl-cyclohexanecarboxylic acid ((S)-1-phenylcarbamoyl-2-pyridin-3-yl-ethyl)-amide | CHEMBL60163
Type:
Small organic molecule
Emp. Form.:
C24H31N3O3S
Mol. Mass.:
441.586
SMILES:
CCO[C@H]1CC[C@](CS)(CC1)C(=O)N[C@@H](Cc1cccnc1)C(=O)Nc1ccccc1 |wU:6.11,14.14,3.2,wD:6.6,(-10.16,-8.95,;-10.16,-7.41,;-8.82,-6.65,;-8.82,-5.11,;-10.16,-4.34,;-10.16,-2.8,;-8.82,-2.03,;-10.16,-1.26,;-10.16,.28,;-7.47,-2.8,;-7.47,-4.34,;-7.47,-1.26,;-7.47,.28,;-6.15,-2.03,;-4.81,-1.26,;-4.81,.28,;-4.06,1.63,;-4.84,2.94,;-4.11,4.29,;-2.57,4.32,;-1.76,2.98,;-2.52,1.64,;-3.49,-2.03,;-3.49,-3.57,;-2.15,-1.26,;-.82,-2.03,;-.8,-3.57,;.52,-4.33,;1.86,-3.56,;1.86,-2.02,;.52,-1.25,)|
Structure:
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