BDBM50354807 CHEMBL1834277

SMILES: Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NC[C@H]1CC[C@@H](CNS(N)(=O)=O)CC1

InChI Key: InChIKey=RHPHCZQYECTNKO-CALCHBBNSA-N

Data: 3 KI

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 3 hits for monomerid = 50354807   

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))	BDBM50354807 (CHEMBL1834277) Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NC[C@H]1CC[C@@H](CNS(N)(=O)=O)CC1 |r,wU:25.27,28.31,(28.13,-41.38,;29.03,-42.62,;30.58,-42.61,;31.05,-44.08,;29.82,-44.99,;28.56,-44.08,;27.19,-44.77,;25.85,-44.01,;24.52,-44.8,;24.54,-46.34,;23.22,-47.12,;25.89,-47.09,;27.21,-46.3,;29.82,-46.53,;28.5,-47.3,;28.49,-48.85,;29.83,-49.62,;29.83,-51.16,;31.16,-48.85,;31.16,-47.3,;32.49,-46.52,;31.34,-41.27,;30.56,-39.95,;32.88,-41.26,;33.66,-42.59,;35.2,-42.58,;35.95,-41.24,;37.49,-41.23,;38.27,-42.57,;39.81,-42.56,;40.58,-41.22,;42.12,-41.22,;42.88,-39.88,;42.1,-42.75,;43.65,-41.21,;37.5,-43.9,;35.97,-43.91,)| Show InChI InChI=1S/C25H28Cl3N5O3S/c1-15-23(25(34)30-13-16-2-4-17(5-3-16)14-31-37(29,35)36)32-33(22-11-10-20(27)12-21(22)28)24(15)18-6-8-19(26)9-7-18/h6-12,16-17,31H,2-5,13-14H2,1H3,(H,30,34)(H2,29,35,36)/t16-,17+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
RTI International Curated by ChEMBL					Assay Description Displacement of [3H]-SR141716A from human CB1 receptor expressed in CHO-K1 cells after 1 hr by liquid scintillation counting				Bioorg Med Chem Lett 21: 5711-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.032 BindingDB Entry DOI: 10.7270/Q2V988HJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50354807 (CHEMBL1834277) Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NC[C@H]1CC[C@@H](CNS(N)(=O)=O)CC1 |r,wU:25.27,28.31,(28.13,-41.38,;29.03,-42.62,;30.58,-42.61,;31.05,-44.08,;29.82,-44.99,;28.56,-44.08,;27.19,-44.77,;25.85,-44.01,;24.52,-44.8,;24.54,-46.34,;23.22,-47.12,;25.89,-47.09,;27.21,-46.3,;29.82,-46.53,;28.5,-47.3,;28.49,-48.85,;29.83,-49.62,;29.83,-51.16,;31.16,-48.85,;31.16,-47.3,;32.49,-46.52,;31.34,-41.27,;30.56,-39.95,;32.88,-41.26,;33.66,-42.59,;35.2,-42.58,;35.95,-41.24,;37.49,-41.23,;38.27,-42.57,;39.81,-42.56,;40.58,-41.22,;42.12,-41.22,;42.88,-39.88,;42.1,-42.75,;43.65,-41.21,;37.5,-43.9,;35.97,-43.91,)| Show InChI InChI=1S/C25H28Cl3N5O3S/c1-15-23(25(34)30-13-16-2-4-17(5-3-16)14-31-37(29,35)36)32-33(22-11-10-20(27)12-21(22)28)24(15)18-6-8-19(26)9-7-18/h6-12,16-17,31H,2-5,13-14H2,1H3,(H,30,34)(H2,29,35,36)/t16-,17+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	107	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
RTI International Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human CB1 receptor expressed in CHO-K1 cells after 1 hr by liquid scintillation spectrometry				Bioorg Med Chem Lett 21: 5711-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.032 BindingDB Entry DOI: 10.7270/Q2V988HJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50354807 (CHEMBL1834277) Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NC[C@H]1CC[C@@H](CNS(N)(=O)=O)CC1 |r,wU:25.27,28.31,(28.13,-41.38,;29.03,-42.62,;30.58,-42.61,;31.05,-44.08,;29.82,-44.99,;28.56,-44.08,;27.19,-44.77,;25.85,-44.01,;24.52,-44.8,;24.54,-46.34,;23.22,-47.12,;25.89,-47.09,;27.21,-46.3,;29.82,-46.53,;28.5,-47.3,;28.49,-48.85,;29.83,-49.62,;29.83,-51.16,;31.16,-48.85,;31.16,-47.3,;32.49,-46.52,;31.34,-41.27,;30.56,-39.95,;32.88,-41.26,;33.66,-42.59,;35.2,-42.58,;35.95,-41.24,;37.49,-41.23,;38.27,-42.57,;39.81,-42.56,;40.58,-41.22,;42.12,-41.22,;42.88,-39.88,;42.1,-42.75,;43.65,-41.21,;37.5,-43.9,;35.97,-43.91,)| Show InChI InChI=1S/C25H28Cl3N5O3S/c1-15-23(25(34)30-13-16-2-4-17(5-3-16)14-31-37(29,35)36)32-33(22-11-10-20(27)12-21(22)28)24(15)18-6-8-19(26)9-7-18/h6-12,16-17,31H,2-5,13-14H2,1H3,(H,30,34)(H2,29,35,36)/t16-,17+	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.79E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
RTI International Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human CB2 receptor expressed in CHO-K1 cells after 1 hr by liquid scintillation spectrometry				Bioorg Med Chem Lett 21: 5711-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.032 BindingDB Entry DOI: 10.7270/Q2V988HJ
					More data for this Ligand-Target Pair