Reaction Details Report a problem with these data
Target
Growth/differentiation factor 8
Ligand
BDBM50537170
Substrate
n/a
Meas. Tech.
ChEMBL_1935870 (CHEMBL4481629)
IC50
260±n/a nM
Citation
 Rentier, C; Takayama, K; Saitoh, M; Nakamura, A; Ikeyama, H; Taguchi, A; Taniguchi, A; Hayashi, Y Design and synthesis of potent myostatin inhibitory cyclic peptides. Bioorg Med Chem 27:1437-1443 (2019) [PubMed]  Article 
Target
Name:
Growth/differentiation factor 8
Synonyms:
GDF-8 | GDF8 | GDF8_HUMAN | Growth/differentiation factor 8 | MSTN | Myostatin
Type:
PROTEIN
Mol. Mass.:
42750.72
Organism:
Homo sapiens (Human)
Description:
ChEMBL_109584
Residue:
375
Sequence:
MQKLQLCVYIYLFMLIVAGPVDLNENSEQKENVEKEGLCNACTWRQNTKSSRIEAIKIQILSKLRLETAPNISKDVIRQLLPKAPPLRELIDQYDVQRDDSSDGSLEDDDYHATTETIITMPTESDFLMQVDGKPKCCFFKFSSKIQYNKVVKAQLWIYLRPVETPTTVFVQILRLIKPMKDGTRYTGIRSLKLDMNPGTGIWQSIDVKTVLQNWLKQPESNLGIEIKALDENGHDLAVTFPGPGEDGLNPFLEVKVTDTPKRSRRDFGLDCDEHSTESRCCRYPLTVDFEAFGWDWIIAPKRYKANYCSGECEFVFLQKYPHTHLVHQANPRGSAGPCCTPTKMSPINMLYFNGKEQIIYGKIPAMVVDRCGCS
  
Inhibitor
Name:
BDBM50537170
Synonyms:
CHEMBL4516740
Type:
Small organic molecule
Emp. Form.:
C143H228N40O35
Mol. Mass.:
3067.5874
SMILES:
CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1COC(=O)CCCC(=O)OC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)COc2ccc3ccccc3c2)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(N)=O |r|
Structure:
Search PDB for entries with ligand similarity: