BDBM50230384 CHEMBL4066919

SMILES: C\C(N)=N/C(=N\S(=O)(=O)c1ccc(cc1)C(C)(C)C)/N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1

InChI Key: InChIKey=FVALVQHGLPFYII-UHFFFAOYSA-N

Data: 2 KI  1 IC50

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 = 50230384   

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 (Mus musculus (Mouse))	BDBM50230384 (CHEMBL4066919) Show SMILES C\C(N)=N/C(=N\S(=O)(=O)c1ccc(cc1)C(C)(C)C)/N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |c:23| Show InChI InChI=1S/C28H30ClN5O2S/c1-19(30)31-27(33-37(35,36)24-16-12-22(13-17-24)28(2,3)4)34-18-25(20-8-6-5-7-9-20)26(32-34)21-10-14-23(29)15-11-21/h5-17,25H,18H2,1-4H3,(H2,30,31,33)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	48	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Alcohol Abuse and Alcoholism Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from mouse brain CB1R expressed in CHOK1 cell membranes				J Med Chem 60: 1126-1141 (2017) BindingDB Entry DOI: 10.7270/Q2WW7KXF
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (MOUSE)	BDBM50230384 (CHEMBL4066919) Show SMILES C\C(N)=N/C(=N\S(=O)(=O)c1ccc(cc1)C(C)(C)C)/N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |c:23| Show InChI InChI=1S/C28H30ClN5O2S/c1-19(30)31-27(33-37(35,36)24-16-12-22(13-17-24)28(2,3)4)34-18-25(20-8-6-5-7-9-20)26(32-34)21-10-14-23(29)15-11-21/h5-17,25H,18H2,1-4H3,(H2,30,31,33)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Alcohol Abuse and Alcoholism Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from mouse CB2R expressed in CHOK1 cell membranes				J Med Chem 60: 1126-1141 (2017) BindingDB Entry DOI: 10.7270/Q2WW7KXF
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Mus musculus (Mouse))	BDBM50230384 (CHEMBL4066919) Show SMILES C\C(N)=N/C(=N\S(=O)(=O)c1ccc(cc1)C(C)(C)C)/N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |c:23| Show InChI InChI=1S/C28H30ClN5O2S/c1-19(30)31-27(33-37(35,36)24-16-12-22(13-17-24)28(2,3)4)34-18-25(20-8-6-5-7-9-20)26(32-34)21-10-14-23(29)15-11-21/h5-17,25H,18H2,1-4H3,(H2,30,31,33)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Alcohol Abuse and Alcoholism Curated by ChEMBL					Assay Description Inverse agonist at mouse brain CB1R expressed in CHOK1 cell membranes assessed as inhibition of CP55940-stimulated [35S]GTP-gammaS binding measured a...				J Med Chem 60: 1126-1141 (2017) BindingDB Entry DOI: 10.7270/Q2WW7KXF
					More data for this Ligand-Target Pair