BDBM50328963 CHEMBL1269772::N,N'-[(Methylimino)diundecane-11,1-diyl]bis[5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-1H-pyrazole-3-carboxamide]

SMILES: CN(CCCCCCCCCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)CCCCCCCCCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl

InChI Key: InChIKey=ROHJMIWUMPPHFT-UHFFFAOYSA-N

Data: 3 KI  2 EC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50328963   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50328963 (CHEMBL1269772 | N,N'-[(Methylimino)diundecane-11,1...) Show SMILES CN(CCCCCCCCCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)CCCCCCCCCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C57H69Cl6N7O2/c1-40-52(66-69(50-32-30-46(60)38-48(50)62)54(40)42-22-26-44(58)27-23-42)56(71)64-34-18-14-10-6-4-8-12-16-20-36-68(3)37-21-17-13-9-5-7-11-15-19-35-65-57(72)53-41(2)55(43-24-28-45(59)29-25-43)70(67-53)51-33-31-47(61)39-49(51)63/h22-33,38-39H,4-21,34-37H2,1-3H3,(H,64,71)(H,65,72)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.29E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Displacement of [3H]SR141716 from human CB1 receptor expressed in HEK293 cells				J Med Chem 53: 7048-60 (2010) Article DOI: 10.1021/jm1006676 BindingDB Entry DOI: 10.7270/Q27P8ZMC
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50328963 (CHEMBL1269772 | N,N'-[(Methylimino)diundecane-11,1...) Show SMILES CN(CCCCCCCCCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)CCCCCCCCCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C57H69Cl6N7O2/c1-40-52(66-69(50-32-30-46(60)38-48(50)62)54(40)42-22-26-44(58)27-23-42)56(71)64-34-18-14-10-6-4-8-12-16-20-36-68(3)37-21-17-13-9-5-7-11-15-19-35-65-57(72)53-41(2)55(43-24-28-45(59)29-25-43)70(67-53)51-33-31-47(61)39-49(51)63/h22-33,38-39H,4-21,34-37H2,1-3H3,(H,64,71)(H,65,72)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.89E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in HEK293 cells				J Med Chem 53: 7048-60 (2010) Article DOI: 10.1021/jm1006676 BindingDB Entry DOI: 10.7270/Q27P8ZMC
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50328963 (CHEMBL1269772 | N,N'-[(Methylimino)diundecane-11,1...) Show SMILES CN(CCCCCCCCCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)CCCCCCCCCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C57H69Cl6N7O2/c1-40-52(66-69(50-32-30-46(60)38-48(50)62)54(40)42-22-26-44(58)27-23-42)56(71)64-34-18-14-10-6-4-8-12-16-20-36-68(3)37-21-17-13-9-5-7-11-15-19-35-65-57(72)53-41(2)55(43-24-28-45(59)29-25-43)70(67-53)51-33-31-47(61)39-49(51)63/h22-33,38-39H,4-21,34-37H2,1-3H3,(H,64,71)(H,65,72)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from human CB2 receptor expressed in CHOK1 cells				J Med Chem 53: 7048-60 (2010) Article DOI: 10.1021/jm1006676 BindingDB Entry DOI: 10.7270/Q27P8ZMC
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50328963 (CHEMBL1269772 | N,N'-[(Methylimino)diundecane-11,1...) Show SMILES CN(CCCCCCCCCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)CCCCCCCCCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C57H69Cl6N7O2/c1-40-52(66-69(50-32-30-46(60)38-48(50)62)54(40)42-22-26-44(58)27-23-42)56(71)64-34-18-14-10-6-4-8-12-16-20-36-68(3)37-21-17-13-9-5-7-11-15-19-35-65-57(72)53-41(2)55(43-24-28-45(59)29-25-43)70(67-53)51-33-31-47(61)39-49(51)63/h22-33,38-39H,4-21,34-37H2,1-3H3,(H,64,71)(H,65,72)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>2.50E+4	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Antagonist activity at human brain CB1 receptor assessed as inhibition for [35S]GTPgammaS binding				J Med Chem 53: 7048-60 (2010) Article DOI: 10.1021/jm1006676 BindingDB Entry DOI: 10.7270/Q27P8ZMC
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Rattus norvegicus (rat))	BDBM50328963 (CHEMBL1269772 | N,N'-[(Methylimino)diundecane-11,1...) Show SMILES CN(CCCCCCCCCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)CCCCCCCCCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C57H69Cl6N7O2/c1-40-52(66-69(50-32-30-46(60)38-48(50)62)54(40)42-22-26-44(58)27-23-42)56(71)64-34-18-14-10-6-4-8-12-16-20-36-68(3)37-21-17-13-9-5-7-11-15-19-35-65-57(72)53-41(2)55(43-24-28-45(59)29-25-43)70(67-53)51-33-31-47(61)39-49(51)63/h22-33,38-39H,4-21,34-37H2,1-3H3,(H,64,71)(H,65,72)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	29.3	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Antagonist activity at rat brain CB1 receptor assessed as inhibition of [35S]GTPgammaS binding				J Med Chem 53: 7048-60 (2010) Article DOI: 10.1021/jm1006676 BindingDB Entry DOI: 10.7270/Q27P8ZMC
					More data for this Ligand-Target Pair