Ki Summary

Reaction Details

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Target

Cannabinoid receptor 1

Ligand

BDBM50298956

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_588141 (CHEMBL1049258)

90±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

BDBM50298956

n/a

Name

BDBM50298956

Synonyms:

CHEMBL572854 | N-(4-Chlorobenzyl)1-(2,4-dichlorophenyl)-5-(2,5-dimethyl-1H-pyrrol-1-yl)-4-methyl-1H-pyrazole-3-carboxamide

Type

Small organic molecule

Emp. Form.

C24H21Cl3N4O

Mol. Mass.

487.809

SMILES

Cc1ccc(C)n1-c1c(C)c(nn1-c1ccc(Cl)cc1Cl)C(=O)NCc1ccc(Cl)cc1 |(-2.69,-38.36,;-1.79,-37.11,;-.25,-37.1,;.21,-35.63,;-1.04,-34.73,;-1.06,-33.19,;-2.28,-35.65,;-3.75,-35.18,;-4.24,-33.72,;-3.35,-32.47,;-5.78,-33.73,;-6.24,-35.2,;-4.99,-36.1,;-4.98,-37.64,;-3.64,-38.4,;-3.63,-39.94,;-4.95,-40.72,;-4.94,-42.26,;-6.3,-39.96,;-6.3,-38.42,;-7.65,-37.66,;-6.69,-32.49,;-6.08,-31.08,;-8.23,-32.66,;-9.14,-31.43,;-10.67,-31.6,;-11.29,-33.01,;-12.81,-33.19,;-13.73,-31.95,;-15.27,-32.12,;-13.12,-30.53,;-11.59,-30.36,)|

Structure