BDBM50184429 16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]octadeca-1(18),3(8),4,6,14,16-hexaene::3-methoxy-7-methyl-5,6,7,8,9,14-hexahydrodibenzo[d,g]azecine::6-methoxy-11-methyl-11-aza-tricyclo[12.4.0.0.3,8]octadeca-1(18),3(8),4,6,14,16-hexaene::CHEMBL380330

SMILES: COc1ccc2Cc3ccccc3CCN(C)CCc2c1

InChI Key: InChIKey=ATCJEKKXEJVYOB-UHFFFAOYSA-N

Data: 18 KI  2 IC50  1 Kd

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 21 hits for monomerid = 50184429   

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
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.550	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universität Jena Curated by ChEMBL					Assay Description Inhibition of D2L dopamine receptor in HEK 293 cells by intracellular calcium assay				J Med Chem 49: 2110-6 (2006) Article DOI: 10.1021/jm051237e BindingDB Entry DOI: 10.7270/Q2ZW1KHD
					More data for this Ligand-Target Pair
D(1B) dopamine receptor (Homo sapiens (Human))	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universität Jena Curated by ChEMBL					Assay Description Inhibition of D5 dopamine receptor in HEK 293 cells by intracellular calcium assay				J Med Chem 49: 2110-6 (2006) Article DOI: 10.1021/jm051237e BindingDB Entry DOI: 10.7270/Q2ZW1KHD
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	12.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universit£t Jena Curated by ChEMBL					Assay Description Displacement of [3H]SCH23390 from human cloned dopamine D2L receptor				Bioorg Med Chem Lett 18: 3809-13 (2008) Article DOI: 10.1016/j.bmcl.2008.04.081 BindingDB Entry DOI: 10.7270/Q23F4QWW
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universität Jena Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from D2L dopamine receptor				J Med Chem 49: 2110-6 (2006) Article DOI: 10.1021/jm051237e BindingDB Entry DOI: 10.7270/Q2ZW1KHD
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universität Jena Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in CHO cells				Bioorg Med Chem Lett 17: 1399-402 (2007) Article DOI: 10.1016/j.bmcl.2006.11.093 BindingDB Entry DOI: 10.7270/Q24T6J1G
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universit£t Jena Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from human dopamine D2L receptor expressed in CHO cells by scintillation counting				Bioorg Med Chem 17: 6898-907 (2009) Article DOI: 10.1016/j.bmc.2009.08.028 BindingDB Entry DOI: 10.7270/Q2SB46P5
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (Homo sapiens (Human))	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	22.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universit£t Jena Curated by ChEMBL					Assay Description Displacement of [3H]SCH23390 from human cloned dopamine D1 receptor				Bioorg Med Chem Lett 18: 3809-13 (2008) Article DOI: 10.1016/j.bmcl.2008.04.081 BindingDB Entry DOI: 10.7270/Q23F4QWW
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (Homo sapiens (Human))	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	24.1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universität Jena Curated by ChEMBL					Assay Description Inhibition of D1 dopamine receptor in HEK 293 cells by intracellular calcium assay				J Med Chem 49: 2110-6 (2006) Article DOI: 10.1021/jm051237e BindingDB Entry DOI: 10.7270/Q2ZW1KHD
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (Homo sapiens (Human))	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	28.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universit£t Jena Curated by ChEMBL					Assay Description Displacement of [3H]SCH23390 from human dopamine D1 receptor expressed in CHO cells by scintillation counting				Bioorg Med Chem 17: 6898-907 (2009) Article DOI: 10.1016/j.bmc.2009.08.028 BindingDB Entry DOI: 10.7270/Q2SB46P5
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (Homo sapiens (Human))	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	28.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universität Jena Curated by ChEMBL					Assay Description Displacement of [3H]SCH 23390 from D1 dopamine receptor				J Med Chem 49: 2110-6 (2006) Article DOI: 10.1021/jm051237e BindingDB Entry DOI: 10.7270/Q2ZW1KHD
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (Homo sapiens (Human))	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	28.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universität Jena Curated by ChEMBL					Assay Description Displacement of [3H]SCH 23390 from human cloned dopamine D1 receptor expressed in HEK 293 cells				Bioorg Med Chem Lett 17: 1399-402 (2007) Article DOI: 10.1016/j.bmcl.2006.11.093 BindingDB Entry DOI: 10.7270/Q24T6J1G
					More data for this Ligand-Target Pair
D(1B) dopamine receptor (Homo sapiens (Human))	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	38.3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universität Jena Curated by ChEMBL					Assay Description Binding affinity to human cloned dopamine D5 receptor expressed in HEK 293 cells				Bioorg Med Chem Lett 17: 1399-402 (2007) Article DOI: 10.1016/j.bmcl.2006.11.093 BindingDB Entry DOI: 10.7270/Q24T6J1G
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	43.4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universit£t Jena Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from human dopamine D4 receptor expressed in CHO cells by scintillation counting				Bioorg Med Chem 17: 6898-907 (2009) Article DOI: 10.1016/j.bmc.2009.08.028 BindingDB Entry DOI: 10.7270/Q2SB46P5
					More data for this Ligand-Target Pair
D(1B) dopamine receptor (Homo sapiens (Human))	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	54	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universität Jena Curated by ChEMBL					Assay Description Displacement of [3H]SCH 23390 from human dopamine D5 receptor expressed in HEK293 cells				J Med Chem 50: 4528-33 (2007) Article DOI: 10.1021/jm070388+ BindingDB Entry DOI: 10.7270/Q2S46RPG
					More data for this Ligand-Target Pair
D(1B) dopamine receptor (Homo sapiens (Human))	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	54	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universit£t Jena Curated by ChEMBL					Assay Description Displacement of [3H]SCH23390 from human dopamine D5 receptor expressed in CHO cells by scintillation counting				Bioorg Med Chem 17: 6898-907 (2009) Article DOI: 10.1016/j.bmc.2009.08.028 BindingDB Entry DOI: 10.7270/Q2SB46P5
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	75.7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universität Jena Curated by ChEMBL					Assay Description Binding affinity to D3 dopamine receptor by radioligand binding assay				J Med Chem 49: 2110-6 (2006) Article DOI: 10.1021/jm051237e BindingDB Entry DOI: 10.7270/Q2ZW1KHD
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	75.7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universität Jena Curated by ChEMBL					Assay Description Binding affinity to human cloned dopamine D3 receptor expressed in CHO cells				Bioorg Med Chem Lett 17: 1399-402 (2007) Article DOI: 10.1016/j.bmcl.2006.11.093 BindingDB Entry DOI: 10.7270/Q24T6J1G
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	75.7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universit£t Jena Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from human dopamine D3 receptor expressed in CHO cells by scintillation counting				Bioorg Med Chem 17: 6898-907 (2009) Article DOI: 10.1016/j.bmc.2009.08.028 BindingDB Entry DOI: 10.7270/Q2SB46P5
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+7	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universit£t Jena Curated by ChEMBL					Assay Description Inhibition of Electric eel AChE after 2 mins by colorimetric Ellman assay				Bioorg Med Chem Lett 20: 2946-9 (2010) Article DOI: 10.1016/j.bmcl.2010.03.011 BindingDB Entry DOI: 10.7270/Q22808KX
					More data for this Ligand-Target Pair
Butyrylcholinesterase (BuChE) (Equus caballus (Horse))	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+7	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universit£t Jena Curated by ChEMBL					Assay Description Inhibition of Equine serum BChE after 2 mins by colorimetric Ellman assay				Bioorg Med Chem Lett 20: 2946-9 (2010) Article DOI: 10.1016/j.bmcl.2010.03.011 BindingDB Entry DOI: 10.7270/Q22808KX
					More data for this Ligand-Target Pair
5-HT2 (PIG)	BDBM50184429 (16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]o...) Show SMILES COc1ccc2Cc3ccccc3CCN(C)CCc2c1 Show InChI InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.04	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universit£t Jena Curated by ChEMBL					Assay Description Antagonist activity at serotonin 5HT2A receptor assessed as effect on 5HT-induced isometric contractile force in isolated rings of pig coronary arter...				Bioorg Med Chem Lett 18: 3809-13 (2008) Article DOI: 10.1016/j.bmcl.2008.04.081 BindingDB Entry DOI: 10.7270/Q23F4QWW
					More data for this Ligand-Target Pair