BDBM50328954 CHEMBL1269019::N,N'-(Iminodipropane-3,1-diyl)bis[5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-1H-pyrazole-3-carboxamide]

SMILES: Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NCCCNCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl

InChI Key: InChIKey=XJGCZUXTCZYDGW-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 = 50328954   

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))	BDBM50328954 (CHEMBL1269019 | N,N'-(Iminodipropane-3,1-diyl)bis[...) Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NCCCNCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C40H35Cl6N7O2/c1-23-35(50-52(33-15-13-29(43)21-31(33)45)37(23)25-5-9-27(41)10-6-25)39(54)48-19-3-17-47-18-4-20-49-40(55)36-24(2)38(26-7-11-28(42)12-8-26)53(51-36)34-16-14-30(44)22-32(34)46/h5-16,21-22,47H,3-4,17-20H2,1-2H3,(H,48,54)(H,49,55)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	41.9	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))	BDBM50328954 (CHEMBL1269019 | N,N'-(Iminodipropane-3,1-diyl)bis[...) Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NCCCNCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C40H35Cl6N7O2/c1-23-35(50-52(33-15-13-29(43)21-31(33)45)37(23)25-5-9-27(41)10-6-25)39(54)48-19-3-17-47-18-4-20-49-40(55)36-24(2)38(26-7-11-28(42)12-8-26)53(51-36)34-16-14-30(44)22-32(34)46/h5-16,21-22,47H,3-4,17-20H2,1-2H3,(H,48,54)(H,49,55)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	174	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))	BDBM50328954 (CHEMBL1269019 | N,N'-(Iminodipropane-3,1-diyl)bis[...) Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NCCCNCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C40H35Cl6N7O2/c1-23-35(50-52(33-15-13-29(43)21-31(33)45)37(23)25-5-9-27(41)10-6-25)39(54)48-19-3-17-47-18-4-20-49-40(55)36-24(2)38(26-7-11-28(42)12-8-26)53(51-36)34-16-14-30(44)22-32(34)46/h5-16,21-22,47H,3-4,17-20H2,1-2H3,(H,48,54)(H,49,55)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	496	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))	BDBM50328954 (CHEMBL1269019 | N,N'-(Iminodipropane-3,1-diyl)bis[...) Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NCCCNCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C40H35Cl6N7O2/c1-23-35(50-52(33-15-13-29(43)21-31(33)45)37(23)25-5-9-27(41)10-6-25)39(54)48-19-3-17-47-18-4-20-49-40(55)36-24(2)38(26-7-11-28(42)12-8-26)53(51-36)34-16-14-30(44)22-32(34)46/h5-16,21-22,47H,3-4,17-20H2,1-2H3,(H,48,54)(H,49,55)	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	84.2	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))	BDBM50328954 (CHEMBL1269019 | N,N'-(Iminodipropane-3,1-diyl)bis[...) Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NCCCNCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C40H35Cl6N7O2/c1-23-35(50-52(33-15-13-29(43)21-31(33)45)37(23)25-5-9-27(41)10-6-25)39(54)48-19-3-17-47-18-4-20-49-40(55)36-24(2)38(26-7-11-28(42)12-8-26)53(51-36)34-16-14-30(44)22-32(34)46/h5-16,21-22,47H,3-4,17-20H2,1-2H3,(H,48,54)(H,49,55)	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	718	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