Ki Summary

Reaction Details

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Target

Cannabinoid receptor 1

Ligand

BDBM50298954

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_588141 (CHEMBL1049258)

30±n/a nM

Citation

Silvestri, R; Ligresti, A; La Regina, G; Piscitelli, F; Gatti, V; Brizzi, A; Pasquini, S; Lavecchia, A; Allarà, M; Fantini, N; Carai, MA; Novellino, E; Colombo, G; Di Marzo, V; Corelli, F Synthesis, cannabinoid receptor affinity, molecular modeling studies and in vivo pharmacological evaluation of new substituted 1-aryl-5-(1H-pyrrol-1-yl)-1H-pyrazole-3-carboxamides. 2. Effect of the 3-carboxamide substituent on the affinity and selectivity profile. Bioorg Med Chem17:5549-64 (2009) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Cannabinoid receptor 1

Name:

Cannabinoid receptor 1

Synonyms:

Type:

G Protein-Coupled Receptor (GPCR)

Mol. Mass.:

52868.96

Organism:

Homo sapiens (Human)

Description:

P21554

Residue:

472

Sequence:

MKSILDGLADTTFRTITTDLLYVGSNDIQYEDIKGDMASKLGYFPQKFPLTSFRGSPFQE
KMTAGDNPQLVPADQVNITEFYNKSLSSFKENEENIQCGENFMDIECFMVLNPSQQLAIA
VLSLTLGTFTVLENLLVLCVILHSRSLRCRPSYHFIGSLAVADLLGSVIFVYSFIDFHVF
HRKDSRNVFLFKLGGVTASFTASVGSLFLTAIDRYISIHRPLAYKRIVTRPKAVVAFCLM
WTIAIVIAVLPLLGWNCEKLQSVCSDIFPHIDETYLMFWIGVTSVLLLFIVYAYMYILWK
AHSHAVRMIQRGTQKSIIIHTSEDGKVQVTRPDQARMDIRLAKTLVLILVVLIICWGPLL
AIMVYDVFGKMNKLIKTVFAFCSMLCLLNSTVNPIIYALRSKDLRHAFRSMFPSCEGTAQ
PLDNSMGDSDCLHKHANNAASVHRAAESCIKSTVKIAKVTMSVSTDTSAEAL

BDBM50298954

n/a

Name

BDBM50298954

Synonyms:

CHEMBL575184 | N-[2-(4-Chlorophenyl)ethyl]1-(2,4-dichlorophenyl)-5-(2,5-dimethyl-1H-pyrrol-1-yl)-4-methyl-1H-pyrazole-3-carboxamide

Type

Small organic molecule

Emp. Form.

C25H23Cl3N4O

Mol. Mass.

501.835

SMILES

Cc1ccc(C)n1-c1c(C)c(nn1-c1ccc(Cl)cc1Cl)C(=O)NCCc1ccc(Cl)cc1 |(32.02,-40.77,;32.93,-39.53,;34.47,-39.54,;34.95,-38.08,;33.71,-37.17,;33.72,-35.63,;32.46,-38.07,;31,-37.59,;30.53,-36.12,;31.44,-34.87,;28.99,-36.11,;28.51,-37.57,;29.75,-38.49,;29.74,-40.02,;31.07,-40.8,;31.06,-42.33,;29.72,-43.1,;29.72,-44.64,;28.39,-42.33,;28.41,-40.78,;27.07,-40.01,;28.09,-34.86,;28.72,-33.45,;26.55,-35.01,;25.65,-33.76,;24.13,-33.91,;23.23,-32.66,;21.69,-32.81,;20.79,-31.56,;21.43,-30.16,;20.53,-28.91,;22.96,-30.01,;23.86,-31.26,)|

Structure