BDBM50007551 3'-chlorospiro[2-cyclohexene-1,5'-(10',11'-dihydro-5'H-dibenzo[a,d]cycloheptene)]-4-yl(dimethyl)amine::CHEMBL45491::Enantiomer 1'3'-chlorospiro[2-cyclohexene-1,5'-(10',11'-dihydro-5'H-dibenzo[a,d]cycloheptene)]-4-yl(dimethyl)amine

SMILES: CN(C)C1CCC2(C=C1)c1ccccc1CCc1ccc(Cl)cc21

InChI Key: InChIKey=QPNVVIACYJVUOX-UHFFFAOYSA-N

Data: 12 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 12 hits for monomerid = 50007551   

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(1A) dopamine receptor (Homo sapiens (Human))	BDBM50007551 (3'-chlorospiro[2-cyclohexene-1,5'-(10',11'-dihydro...) Show SMILES CN(C)C1CCC2(C=C1)c1ccccc1CCc1ccc(Cl)cc21 |c:7| Show InChI InChI=1S/C22H24ClN/c1-24(2)19-11-13-22(14-12-19)20-6-4-3-5-16(20)7-8-17-9-10-18(23)15-21(17)22/h3-6,9-11,13,15,19H,7-8,12,14H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	0.330	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Binding affinity determined in radioreceptor binding assay by using [3H]-SCH-23,390 radioligand against dopamine receptor D1				J Med Chem 34: 1707-14 (1991) BindingDB Entry DOI: 10.7270/Q2ZP4534
					More data for this Ligand-Target Pair
Serotonin 2 (5-HT2) receptor (Homo sapiens (Human))	BDBM50007551 (3'-chlorospiro[2-cyclohexene-1,5'-(10',11'-dihydro...) Show SMILES CN(C)C1CCC2(C=C1)c1ccccc1CCc1ccc(Cl)cc21 |c:7| Show InChI InChI=1S/C22H24ClN/c1-24(2)19-11-13-22(14-12-19)20-6-4-3-5-16(20)7-8-17-9-10-18(23)15-21(17)22/h3-6,9-11,13,15,19H,7-8,12,14H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	0.570	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Binding affinity determined in radioreceptor binding assay by using [3H]-SCH-23,390 radioligand against dopamine receptor D1				J Med Chem 34: 1707-14 (1991) BindingDB Entry DOI: 10.7270/Q2ZP4534
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50007551 (3'-chlorospiro[2-cyclohexene-1,5'-(10',11'-dihydro...) Show SMILES CN(C)C1CCC2(C=C1)c1ccccc1CCc1ccc(Cl)cc21 |c:7| Show InChI InChI=1S/C22H24ClN/c1-24(2)19-11-13-22(14-12-19)20-6-4-3-5-16(20)7-8-17-9-10-18(23)15-21(17)22/h3-6,9-11,13,15,19H,7-8,12,14H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description The compound was tested for binding affinity against dopamine receptor D2 using raclopride as radioligand				J Med Chem 34: 1707-14 (1991) BindingDB Entry DOI: 10.7270/Q2ZP4534
					More data for this Ligand-Target Pair
Alpha-1A adrenergic receptor (Homo sapiens (Human))	BDBM50007551 (3'-chlorospiro[2-cyclohexene-1,5'-(10',11'-dihydro...) Show SMILES CN(C)C1CCC2(C=C1)c1ccccc1CCc1ccc(Cl)cc21 |c:7| Show InChI InChI=1S/C22H24ClN/c1-24(2)19-11-13-22(14-12-19)20-6-4-3-5-16(20)7-8-17-9-10-18(23)15-21(17)22/h3-6,9-11,13,15,19H,7-8,12,14H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description The compound was tested for binding affinity against Alpha-1 adrenergic receptor using WB-4101 as radioligand				J Med Chem 34: 1707-14 (1991) BindingDB Entry DOI: 10.7270/Q2ZP4534
					More data for this Ligand-Target Pair
Serotonin 2 (5-HT2) receptor (Homo sapiens (Human))	BDBM50007551 (3'-chlorospiro[2-cyclohexene-1,5'-(10',11'-dihydro...) Show SMILES CN(C)C1CCC2(C=C1)c1ccccc1CCc1ccc(Cl)cc21 |c:7| Show InChI InChI=1S/C22H24ClN/c1-24(2)19-11-13-22(14-12-19)20-6-4-3-5-16(20)7-8-17-9-10-18(23)15-21(17)22/h3-6,9-11,13,15,19H,7-8,12,14H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description The compound was tested for binding affinity against dopamine receptor D2 using raclopride as radioligand				J Med Chem 34: 1707-14 (1991) BindingDB Entry DOI: 10.7270/Q2ZP4534
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor (Homo sapiens (Human))	BDBM50007551 (3'-chlorospiro[2-cyclohexene-1,5'-(10',11'-dihydro...) Show SMILES CN(C)C1CCC2(C=C1)c1ccccc1CCc1ccc(Cl)cc21 |c:7| Show InChI InChI=1S/C22H24ClN/c1-24(2)19-11-13-22(14-12-19)20-6-4-3-5-16(20)7-8-17-9-10-18(23)15-21(17)22/h3-6,9-11,13,15,19H,7-8,12,14H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	43	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description The compound was tested for binding affinity against muscarinic acetylcholine receptor using QNB as radioligand				J Med Chem 34: 1707-14 (1991) BindingDB Entry DOI: 10.7270/Q2ZP4534
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (Homo sapiens (Human))	BDBM50007551 (3'-chlorospiro[2-cyclohexene-1,5'-(10',11'-dihydro...) Show SMILES CN(C)C1CCC2(C=C1)c1ccccc1CCc1ccc(Cl)cc21 |c:7| Show InChI InChI=1S/C22H24ClN/c1-24(2)19-11-13-22(14-12-19)20-6-4-3-5-16(20)7-8-17-9-10-18(23)15-21(17)22/h3-6,9-11,13,15,19H,7-8,12,14H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	68	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Binding affinity determined in radioreceptor binding assay by using [3H]SCH-23390 radioligand against dopamine receptor D1				J Med Chem 34: 1707-14 (1991) BindingDB Entry DOI: 10.7270/Q2ZP4534
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor (Homo sapiens (Human))	BDBM50007551 (3'-chlorospiro[2-cyclohexene-1,5'-(10',11'-dihydro...) Show SMILES CN(C)C1CCC2(C=C1)c1ccccc1CCc1ccc(Cl)cc21 |c:7| Show InChI InChI=1S/C22H24ClN/c1-24(2)19-11-13-22(14-12-19)20-6-4-3-5-16(20)7-8-17-9-10-18(23)15-21(17)22/h3-6,9-11,13,15,19H,7-8,12,14H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	94	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description The compound was tested for binding affinity against muscarinic acetylcholine receptor using QNB as radioligand				J Med Chem 34: 1707-14 (1991) BindingDB Entry DOI: 10.7270/Q2ZP4534
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50007551 (3'-chlorospiro[2-cyclohexene-1,5'-(10',11'-dihydro...) Show SMILES CN(C)C1CCC2(C=C1)c1ccccc1CCc1ccc(Cl)cc21 |c:7| Show InChI InChI=1S/C22H24ClN/c1-24(2)19-11-13-22(14-12-19)20-6-4-3-5-16(20)7-8-17-9-10-18(23)15-21(17)22/h3-6,9-11,13,15,19H,7-8,12,14H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description The compound was tested for binding affinity against Alpha-1 adrenergic receptor using WB4101 as radioligand				J Med Chem 34: 1707-14 (1991) BindingDB Entry DOI: 10.7270/Q2ZP4534
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50007551 (3'-chlorospiro[2-cyclohexene-1,5'-(10',11'-dihydro...) Show SMILES CN(C)C1CCC2(C=C1)c1ccccc1CCc1ccc(Cl)cc21 |c:7| Show InChI InChI=1S/C22H24ClN/c1-24(2)19-11-13-22(14-12-19)20-6-4-3-5-16(20)7-8-17-9-10-18(23)15-21(17)22/h3-6,9-11,13,15,19H,7-8,12,14H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	550	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description The compound was tested for binding affinity against sigma receptor using DTG as radioligand				J Med Chem 34: 1707-14 (1991) BindingDB Entry DOI: 10.7270/Q2ZP4534
					More data for this Ligand-Target Pair
Alpha-1A adrenergic receptor (Homo sapiens (Human))	BDBM50007551 (3'-chlorospiro[2-cyclohexene-1,5'-(10',11'-dihydro...) Show SMILES CN(C)C1CCC2(C=C1)c1ccccc1CCc1ccc(Cl)cc21 |c:7| Show InChI InChI=1S/C22H24ClN/c1-24(2)19-11-13-22(14-12-19)20-6-4-3-5-16(20)7-8-17-9-10-18(23)15-21(17)22/h3-6,9-11,13,15,19H,7-8,12,14H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	680	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description The compound was tested for binding affinity against Alpha-1 adrenergic receptor using WB4101 as radioligand				J Med Chem 34: 1707-14 (1991) BindingDB Entry DOI: 10.7270/Q2ZP4534
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50007551 (3'-chlorospiro[2-cyclohexene-1,5'-(10',11'-dihydro...) Show SMILES CN(C)C1CCC2(C=C1)c1ccccc1CCc1ccc(Cl)cc21 |c:7| Show InChI InChI=1S/C22H24ClN/c1-24(2)19-11-13-22(14-12-19)20-6-4-3-5-16(20)7-8-17-9-10-18(23)15-21(17)22/h3-6,9-11,13,15,19H,7-8,12,14H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description The compound was tested for binding affinity against sigma receptor using DTG as radioligand				J Med Chem 34: 1707-14 (1991) BindingDB Entry DOI: 10.7270/Q2ZP4534
					More data for this Ligand-Target Pair