Reaction Details Report a problem with these data
Target
Neuropeptides B/W receptor type 1
Ligand
BDBM50553728
Substrate
n/a
Meas. Tech.
ChEMBL_2214230 (CHEMBL5127362)
IC50
30±n/a nM
Citation
 de Esch, IJP; Erlanson, DA; Jahnke, W; Johnson, CN; Walsh, L Fragment-to-Lead Medicinal Chemistry Publications in 2020. J Med Chem 65:84-99 (2022) [PubMed] 
Target
Name:
Neuropeptides B/W receptor type 1
Synonyms:
GPR7 | NPBW1_HUMAN | NPBWR1 | neuropeptides B/W receptor 1
Type:
Enzyme Catalytic Domain
Mol. Mass.:
36111.82
Organism:
Homo sapiens (Human)
Description:
gi_119607128
Residue:
328
Sequence:
MDNASFSEPWPANASGPDPALSCSNASTLAPLPAPLAVAVPVVYAVICAVGLAGNSAVLYVLLRAPRMKTVTNLFILNLAIADELFTLVLPINIADFLLRQWPFGELMCKLIVAIDQYNTFSSLYFLTVMSADRYLVVLATAESRRVAGRTYSAARAVSLAVWGIVTLVVLPFAVFARLDDEQGRRQCVLVFPQPEAFWWRASRLYTLVLGFAIPVSTICVLYTTLLCRLHAMRLDSHAKALERAKKRVTFLVVAILAVCLLCWTPYHLSTVVALTTDLPQTPLVIAISYFITSLSYANSCLNPFLYAFLDASFRRNLRQLITCRAAA
  
Inhibitor
Name:
BDBM50553728
Synonyms:
CHEMBL4757321
Type:
Small organic molecule
Emp. Form.:
C17H9Cl2F3N4
Mol. Mass.:
397.181
SMILES:
FC(F)(F)c1ccc2[nH]c(nc2c1)-c1c(Cl)cc(cc1Cl)-c1cn[nH]c1
Structure:
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