BDBM76039 2,3-dihydro-1,4-benzodioxin-6-yl-[4-(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-piperazinyl]methanone::2,3-dihydro-1,4-benzodioxin-6-yl-[4-(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperazin-1-yl]methanone::2,3-dihydro-1,4-benzodioxin-6-yl-[4-(2-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl)piperazino]methanone::MLS-0437137.0001::cid_1434989

SMILES: Cc1nc(N2CCN(CC2)C(=O)c2ccc3OCCOc3c2)c2c3CCCCc3sc2n1

InChI Key: InChIKey=UZKMXFJXIWPKIR-UHFFFAOYSA-N

Data: 4 IC50  3 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 7 hits for monomerid = 76039   

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 2 (Homo sapiens (Human))	BDBM76039 (2,3-dihydro-1,4-benzodioxin-6-yl-[4-(2-methyl-5,6,...) Show SMILES Cc1nc(N2CCN(CC2)C(=O)c2ccc3OCCOc3c2)c2c3CCCCc3sc2n1 Show InChI InChI=1S/C24H26N4O3S/c1-15-25-22(21-17-4-2-3-5-20(17)32-23(21)26-15)27-8-10-28(11-9-27)24(29)16-6-7-18-19(14-16)31-13-12-30-18/h6-7,14H,2-5,8-13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	>3.20E+4	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Netw...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2348HTX
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM76039 (2,3-dihydro-1,4-benzodioxin-6-yl-[4-(2-methyl-5,6,...) Show SMILES Cc1nc(N2CCN(CC2)C(=O)c2ccc3OCCOc3c2)c2c3CCCCc3sc2n1 Show InChI InChI=1S/C24H26N4O3S/c1-15-25-22(21-17-4-2-3-5-20(17)32-23(21)26-15)27-8-10-28(11-9-27)24(29)16-6-7-18-19(14-16)31-13-12-30-18/h6-7,14H,2-5,8-13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.42E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Netw...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2ZC81B1
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM76039 (2,3-dihydro-1,4-benzodioxin-6-yl-[4-(2-methyl-5,6,...) Show SMILES Cc1nc(N2CCN(CC2)C(=O)c2ccc3OCCOc3c2)c2c3CCCCc3sc2n1 Show InChI InChI=1S/C24H26N4O3S/c1-15-25-22(21-17-4-2-3-5-20(17)32-23(21)26-15)27-8-10-28(11-9-27)24(29)16-6-7-18-19(14-16)31-13-12-30-18/h6-7,14H,2-5,8-13H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	>3.20E+4	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego) Network...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2TM78KV
					More data for this Ligand-Target Pair
G-protein coupled receptor 55 (Homo sapiens (Human))	BDBM76039 (2,3-dihydro-1,4-benzodioxin-6-yl-[4-(2-methyl-5,6,...) Show SMILES Cc1nc(N2CCN(CC2)C(=O)c2ccc3OCCOc3c2)c2c3CCCCc3sc2n1 Show InChI InChI=1S/C24H26N4O3S/c1-15-25-22(21-17-4-2-3-5-20(17)32-23(21)26-15)27-8-10-28(11-9-27)24(29)16-6-7-18-19(14-16)31-13-12-30-18/h6-7,14H,2-5,8-13H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.14E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics(SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q29K48QH
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM76039 (2,3-dihydro-1,4-benzodioxin-6-yl-[4-(2-methyl-5,6,...) Show SMILES Cc1nc(N2CCN(CC2)C(=O)c2ccc3OCCOc3c2)c2c3CCCCc3sc2n1 Show InChI InChI=1S/C24H26N4O3S/c1-15-25-22(21-17-4-2-3-5-20(17)32-23(21)26-15)27-8-10-28(11-9-27)24(29)16-6-7-18-19(14-16)31-13-12-30-18/h6-7,14H,2-5,8-13H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	3.36E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego) Network...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2K35S3P
					More data for this Ligand-Target Pair
G-protein coupled receptor 35 (Homo sapiens (Human))	BDBM76039 (2,3-dihydro-1,4-benzodioxin-6-yl-[4-(2-methyl-5,6,...) Show SMILES Cc1nc(N2CCN(CC2)C(=O)c2ccc3OCCOc3c2)c2c3CCCCc3sc2n1 Show InChI InChI=1S/C24H26N4O3S/c1-15-25-22(21-17-4-2-3-5-20(17)32-23(21)26-15)27-8-10-28(11-9-27)24(29)16-6-7-18-19(14-16)31-13-12-30-18/h6-7,14H,2-5,8-13H2,1H3	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	>3.20E+4	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics Source Affiliation: Sanford-Burnham Medical Research Institute Network: NIH Molecular Libr...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2FB51DS
					More data for this Ligand-Target Pair
G-protein coupled receptor 35 (Homo sapiens (Human))	BDBM76039 (2,3-dihydro-1,4-benzodioxin-6-yl-[4-(2-methyl-5,6,...) Show SMILES Cc1nc(N2CCN(CC2)C(=O)c2ccc3OCCOc3c2)c2c3CCCCc3sc2n1 Show InChI InChI=1S/C24H26N4O3S/c1-15-25-22(21-17-4-2-3-5-20(17)32-23(21)26-15)27-8-10-28(11-9-27)24(29)16-6-7-18-19(14-16)31-13-12-30-18/h6-7,14H,2-5,8-13H2,1H3	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>3.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2PV6HTP
					More data for this Ligand-Target Pair