Reaction Details Report a problem with these data
Target
Melanin-concentrating hormone receptor 1
Ligand
BDBM50190270
Substrate
n/a
Meas. Tech.
ChEMBL_405654 (CHEMBL869867)
Ki
29±n/a nM
Citation
 Rowbottom, MW; Vickers, TD; Dyck, B; Grey, J; Tamiya, J; Zhang, M; Kiankarimi, M; Wu, D; Dwight, W; Wade, WS; Schwarz, D; Heise, CE; Madan, A; Fisher, A; Petroski, R; Goodfellow, VS Synthesis and structure-activity relationships of retro bis-aminopyrrolidine urea (rAPU) derived small-molecule antagonists of the melanin-concentrating hormone receptor-1 (MCH-R1). Part 1. Bioorg Med Chem Lett 16:4450-7 (2006) [PubMed]  Article 
Target
Name:
Melanin-concentrating hormone receptor 1
Synonyms:
G-protein coupled receptor 24 | GPR24 | MCH receptor 1 | MCH-1R | MCH-R1 | MCHR | MCHR-1 | MCHR1 | MCHR1_HUMAN | Melanin Concentrating Hormone 1 | Melanin-Concentrating Hormone Receptor 1 (MCH1R) | Melanin-concentrating hormone receptor | Melanin-concentrating hormone receptor 1 (MCH-1) | Melanin-concentrating hormone receptor 1 (MCH1) | Melanin-concentrating hormone receptor 1 (MCHR-1) | Melanin-concentrating hormone receptor 1 (MCHR1) | SLC-1 | SLC1 | Somatostatin receptor-like protein
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
45976.27
Organism:
Homo sapiens (Human)
Description:
Membranes from CHO-K1 cells stably expressing human MCH1R were used in assays.
Residue:
422
Sequence:
MSVGAMKKGVGRAVGLGGGSGCQATEEDPLPNCGACAPGQGGRRWRLPQPAWVEGSSARLWEQATGTGWMDLEASLLPTGPNASNTSDGPDNLTSAGSPPRTGSISYINIIMPSVFGTICLLGIIGNSTVIFAVVKKSKLHWCNNVPDIFIINLSVVDLLFLLGMPFMIHQLMGNGVWHFGETMCTLITAMDANSQFTSTYILTAMAIDRYLATVHPISSTKFRKPSVATLVICLLWALSFISITPVWLYARLIPFPGGAVGCGIRLPNPDTDLYWFTLYQFFLAFALPFVVITAAYVRILQRMTSSVAPASQRSIRLRTKRVTRTAIAICLVFFVCWAPYYVLQLTQLSISRPTLTFVYLYNAAISLGYANSCLNPFVYIVLCETFRKRLVLSVKPAAQGQLRAVSNAQTADEERTESKGT
  
Inhibitor
Name:
BDBM50190270
Synonyms:
4'-trifluoromethyl-biphenyl-4-carboxylic acid methyl-((S)-1-{(R)-3-[methyl-(4-methyl-cyclohexyl)-amino]-pyrrolidine-1-carbonyl}-pyrrolidin-3-yl)-amide | CHEMBL385959
Type:
Small organic molecule
Emp. Form.:
C32H41F3N4O2
Mol. Mass.:
570.6887
SMILES:
CC1CCC(CC1)N(C)[C@@H]1CCN(C1)C(=O)N1CC[C@@H](C1)N(C)C(=O)c1ccc(cc1)-c1ccc(cc1)C(F)(F)F |wU:19.23,wD:9.9,(25.43,-11.56,;23.89,-11.62,;23.17,-12.99,;21.64,-13.05,;20.82,-11.75,;21.52,-10.38,;23.06,-10.32,;19.28,-11.82,;18.54,-13.17,;18.18,-10.74,;16.93,-11.63,;15.69,-10.71,;16.19,-9.26,;17.73,-9.27,;15.38,-7.95,;16.11,-6.61,;13.84,-8,;12.9,-6.8,;11.45,-7.31,;11.5,-8.85,;12.97,-9.28,;10.17,-9.63,;10.18,-11.17,;8.83,-8.86,;8.82,-7.32,;7.51,-9.64,;7.51,-11.18,;6.18,-11.96,;4.85,-11.19,;4.83,-9.66,;6.16,-8.88,;3.52,-11.96,;3.53,-13.52,;2.18,-14.29,;.85,-13.52,;.86,-11.97,;2.18,-11.2,;-.48,-14.28,;-1.82,-15.04,;.28,-15.62,;-1.25,-12.95,)|
Structure:
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