Reaction Details Report a problem with these data
Target
Neuropeptide FF receptor 1
Ligand
BDBM50583770
Substrate
n/a
Meas. Tech.
ChEMBL_2158113 (CHEMBL5042863)
Ki
6.3±n/a nM
Citation
 Quillet, R; Schneider, S; Utard, V; Drieu la Rochelle, A; Elhabazi, K; Henningsen, JB; Gizzi, P; Schmitt, M; Kugler, V; Simonneaux, V; Ilien, B; Simonin, F; Bihel, F Identification of an  J Med Chem 64:7555-7564 (2021) [PubMed]  Article 
Target
Name:
Neuropeptide FF receptor 1
Synonyms:
G-protein coupled receptor 147 | GPR147 | NPFF1 | NPFF1_HUMAN | NPFFR1 | RFamide-related peptide receptor OT7T022
Type:
PROTEIN
Mol. Mass.:
47840.07
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1474637
Residue:
430
Sequence:
MEGEPSQPPNSSWPLSQNGTNTEATPATNLTFSSYYQHTSPVAAMFIVAYALIFLLCMVGNTLVCFIVLKNRHMHTVTNMFILNLAVSDLLVGIFCMPTTLVDNLITGWPFDNATCKMSGLVQGMSVSASVFTLVAIAVERFRCIVHPFREKLTLRKALVTIAVIWALALLIMCPSAVTLTVTREEHHFMVDARNRSYPLYSCWEAWPEKGMRRVYTTVLFSHIYLAPLALIVVMYARIARKLCQAPGPAPGGEEAADPRASRRRARVVHMLVMVALFFTLSWLPLWALLLLIDYGQLSAPQLHLVTVYAFPFAHWLAFFNSSANPIIYGYFNENFRRGFQAAFRARLCPRPSGSHKEAYSERPGGLLHRRVFVVVRPSDSGLPSESGPSSGAPRPGRLPLRNGRVAHHGLPREGPGCSHLPLTIPAWDI
  
Inhibitor
Name:
BDBM50583770
Synonyms:
CHEMBL5071745
Type:
Small organic molecule
Emp. Form.:
C32H35N7O3
Mol. Mass.:
565.6654
SMILES:
NC(=N)NCCC[C@@H](NC(=O)C=C(c1ccccc1)c1ccccc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(N)=O |r,wU:28.30,wD:7.6,(81.19,-21.98,;82.53,-22.75,;83.86,-21.97,;82.53,-24.29,;81.2,-25.06,;81.2,-26.6,;79.87,-27.38,;79.88,-28.92,;78.54,-29.69,;77.21,-28.93,;77.21,-27.39,;75.88,-29.7,;74.54,-28.94,;73.21,-29.71,;71.87,-28.95,;70.54,-29.72,;70.54,-31.27,;71.88,-32.04,;73.22,-31.26,;74.54,-27.41,;75.87,-26.63,;75.87,-25.09,;74.53,-24.33,;73.19,-25.11,;73.2,-26.64,;81.22,-29.68,;81.22,-31.22,;82.55,-28.91,;83.89,-29.67,;83.89,-31.21,;85.23,-31.98,;86.64,-31.34,;87.67,-32.49,;86.91,-33.82,;87.38,-35.27,;86.37,-36.42,;84.86,-36.1,;84.38,-34.65,;85.41,-33.51,;85.22,-28.9,;86.56,-29.66,;85.21,-27.36,)|
Structure:
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