BDBM50230409 CHEMBL4100767

SMILES: COc1cccc(c1)C(\N)=N/C(=N\S(=O)(=O)c1ccc(Cl)cc1)/N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1

InChI Key: InChIKey=GBALTQDOULZRTG-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 = 50230409   

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))	BDBM50230409 (CHEMBL4100767) Show SMILES COc1cccc(c1)C(\N)=N/C(=N\S(=O)(=O)c1ccc(Cl)cc1)/N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |c:28| Show InChI InChI=1S/C30H25Cl2N5O3S/c1-40-25-9-5-8-22(18-25)29(33)34-30(36-41(38,39)26-16-14-24(32)15-17-26)37-19-27(20-6-3-2-4-7-20)28(35-37)21-10-12-23(31)13-11-21/h2-18,27H,19H2,1H3,(H2,33,34,36)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	86	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)	BDBM50230409 (CHEMBL4100767) Show SMILES COc1cccc(c1)C(\N)=N/C(=N\S(=O)(=O)c1ccc(Cl)cc1)/N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |c:28| Show InChI InChI=1S/C30H25Cl2N5O3S/c1-40-25-9-5-8-22(18-25)29(33)34-30(36-41(38,39)26-16-14-24(32)15-17-26)37-19-27(20-6-3-2-4-7-20)28(35-37)21-10-12-23(31)13-11-21/h2-18,27H,19H2,1H3,(H2,33,34,36)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	161	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))	BDBM50230409 (CHEMBL4100767) Show SMILES COc1cccc(c1)C(\N)=N/C(=N\S(=O)(=O)c1ccc(Cl)cc1)/N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |c:28| Show InChI InChI=1S/C30H25Cl2N5O3S/c1-40-25-9-5-8-22(18-25)29(33)34-30(36-41(38,39)26-16-14-24(32)15-17-26)37-19-27(20-6-3-2-4-7-20)28(35-37)21-10-12-23(31)13-11-21/h2-18,27H,19H2,1H3,(H2,33,34,36)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	33	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