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Target
Cannabinoid receptor 1
Ligand
BDBM50198533
Substrate
n/a
Meas. Tech.
ChEMBL_437693 (CHEMBL905968)
Ki
450±n/a nM
Citation
 Smith, RA; Fathi, Z; Brown, SE; Choi, S; Fan, J; Jenkins, S; Kluender, HC; Konkar, A; Lavoie, R; Mays, R; Natoli, J; O'Connor, SJ; Ortiz, AA; Podlogar, B; Taing, C; Tomlinson, S; Tritto, T; Zhang, Z Constrained analogs of CB-1 antagonists: 1,5,6,7-Tetrahydro-4H-pyrrolo[3,2-c]pyridine-4-one derivatives. Bioorg Med Chem Lett 17:673-8 (2007) [PubMed]  Article 
Target
Name:
Cannabinoid receptor 1
Synonyms:
CANN6 | CANNABINOID CB1 | CB-R | CB1 | CNR | CNR1 | CNR1_HUMAN | Cannabinoid CB1 receptor | Cannabinoid receptor | Cannabinoid receptor 1 (CB1) | Cannabinoid receptor 1 (brain)
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
52868.96
Organism:
Homo sapiens (Human)
Description:
P21554
Residue:
472
Sequence:
MKSILDGLADTTFRTITTDLLYVGSNDIQYEDIKGDMASKLGYFPQKFPLTSFRGSPFQEKMTAGDNPQLVPADQVNITEFYNKSLSSFKENEENIQCGENFMDIECFMVLNPSQQLAIAVLSLTLGTFTVLENLLVLCVILHSRSLRCRPSYHFIGSLAVADLLGSVIFVYSFIDFHVFHRKDSRNVFLFKLGGVTASFTASVGSLFLTAIDRYISIHRPLAYKRIVTRPKAVVAFCLMWTIAIVIAVLPLLGWNCEKLQSVCSDIFPHIDETYLMFWIGVTSVLLLFIVYAYMYILWKAHSHAVRMIQRGTQKSIIIHTSEDGKVQVTRPDQARMDIRLAKTLVLILVVLIICWGPLLAIMVYDVFGKMNKLIKTVFAFCSMLCLLNSTVNPIIYALRSKDLRHAFRSMFPSCEGTAQPLDNSMGDSDCLHKHANNAASVHRAAESCIKSTVKIAKVTMSVSTDTSAEAL
  
Inhibitor
Name:
BDBM50198533
Synonyms:
2-(3-aminophenyl)-5-cyclohexyl-1-(2,4-dichlorophenyl)-3-methyl-6,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4(5H)-one | CHEMBL230784
Type:
Small organic molecule
Emp. Form.:
C26H27Cl2N3O
Mol. Mass.:
468.418
SMILES:
Cc1c2c(CCN(C3CCCCC3)C2=O)n(c1-c1cccc(N)c1)-c1ccc(Cl)cc1Cl |(-1.42,5.62,;-.93,4.16,;.55,3.69,;.56,2.14,;1.89,1.37,;3.23,2.14,;3.23,3.69,;4.56,4.45,;5.9,3.67,;7.23,4.43,;7.24,5.97,;5.91,6.75,;4.57,5.98,;1.89,4.46,;1.89,6,;-.92,1.65,;-1.83,2.9,;-3.37,2.88,;-4.12,1.54,;-5.65,1.53,;-6.44,2.86,;-5.68,4.2,;-6.46,5.52,;-4.14,4.21,;-1.38,.19,;-2.89,-.13,;-3.36,-1.6,;-2.32,-2.74,;-2.79,-4.21,;-.81,-2.41,;-.35,-.94,;1.15,-.61,)|
Structure:
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