Reaction Details  Report a problem with these data
Target
Tryptophan 5-hydroxylase 1
Ligand
BDBM50019143
Substrate
n/a
Meas. Tech.
ChEMBL_2057947 (CHEMBL4712948)
IC50
583±n/a nM
Citation
 Bae, EJ; Choi, WG; Pagire, HS; Pagire, SH; Parameswaran, S; Choi, JH; Yoon, J; Choi, WI; Lee, JH; Song, JS; Bae, MA; Kim, M; Jeon, JH; Lee, IK; Kim, H; Ahn, JH Peripheral Selective Oxadiazolylphenyl Alanine Derivatives as Tryptophan Hydroxylase 1 Inhibitors for Obesity and Fatty Liver Disease. J Med Chem 64:1037-1053 (2021) [PubMed]  Article
Target
Name:
Tryptophan 5-hydroxylase 1
Synonyms:
TPH | TPH1 | TPH1_HUMAN | TPRH | TRPH | Tryptophan 5-monooxygenase 1
Type:
PROTEIN
Mol. Mass.:
50990.64
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1361824
Residue:
444
Sequence:
MIEDNKENKDHSLERGRASLIFSLKNEVGGLIKALKIFQEKHVNLLHIESRKSKRRNSEFEIFVDCDINREQLNDIFHLLKSHTNVLSVNLPDNFTLKEDGMETVPWFPKKISDLDHCANRVLMYGSELDADHPGFKDNVYRKRRKYFADLAMNYKHGDPIPKVEFTEEEIKTWGTVFQELNKLYPTHACREYLKNLPLLSKYCGYREDNIPQLEDVSNFLKERTGFSIRPVAGYLSPRDFLSGLAFRVFHCTQYVRHSSDPFYTPEPDTCHELLGHVPLLAEPSFAQFSQEIGLASLGASEEAVQKLATCYFFTVEFGLCKQDGQLRVFGAGLLSSISELKHALSGHAKVKPFDPKITCKQECLITTFQDVYFVSESFEDAKEKMREFTKTIKRPFGVKYNPYTRSIQILKDTKSITSAMNELQHDLDVVSDALAKVSRKPSI
  
Inhibitor
Name:
BDBM50019143
Synonyms:
CHEMBL511275 | US10683309, Example LP533401
Type:
Small organic molecule
Emp. Form.:
C27H22F4N4O3
Mol. Mass.:
526.4822
SMILES:
N[C@@H](Cc1ccc(cc1)-c1cc(OC(c2ccc(cc2)-c2cccc(F)c2)C(F)(F)F)nc(N)n1)C(O)=O |r|
Structure:
Search PDB for entries with ligand similarity: