BDBM50010597 1-(5-Isopropylidene-5H-dibenzo[a,d]cyclohepten-10-yl)-4-methyl-piperazine::CHEMBL88870

SMILES: [#6]-[#7]-1-[#6]-[#6]-[#7](-[#6]-[#6]-1)-[#6]-1=[#6]-c2ccccc2\[#6](=[#6](\[#6])-[#6])-c2ccccc-12

InChI Key: InChIKey=NJUSHLPQKJYNMD-UHFFFAOYSA-N

Data: 6 KI  3 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 9 hits for monomerid = 50010597   

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
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor (Rattus norvegicus-RAT)	BDBM50010597 (1-(5-Isopropylidene-5H-dibenzo[a,d]cyclohepten-10-...) Show SMILES [#6]-[#7]-1-[#6]-[#6]-[#7](-[#6]-[#6]-1)-[#6]-1=[#6]-c2ccccc2\[#6](=[#6](\[#6])-[#6])-c2ccccc-12 |t:8| Show InChI InChI=1S/C23H26N2/c1-17(2)23-19-9-5-4-8-18(19)16-22(20-10-6-7-11-21(20)23)25-14-12-24(3)13-15-25/h4-11,16H,12-15H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	81	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vanderbilt University Curated by ChEMBL					Assay Description Affinity was evaluated by inhibition of [3H]-GR-65,630 binding to NG108-15 cell transfected with cloned rat 5-hydroxytryptamine 3 receptor				J Med Chem 37: 2686-96 (1994) BindingDB Entry DOI: 10.7270/Q28051NX
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (RAT)	BDBM50010597 (1-(5-Isopropylidene-5H-dibenzo[a,d]cyclohepten-10-...) Show SMILES [#6]-[#7]-1-[#6]-[#6]-[#7](-[#6]-[#6]-1)-[#6]-1=[#6]-c2ccccc2\[#6](=[#6](\[#6])-[#6])-c2ccccc-12 |t:8| Show InChI InChI=1S/C23H26N2/c1-17(2)23-19-9-5-4-8-18(19)16-22(20-10-6-7-11-21(20)23)25-14-12-24(3)13-15-25/h4-11,16H,12-15H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	120	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vanderbilt University Curated by ChEMBL					Assay Description Affinity of the compound was evaluated as inhibition constant for dopamine receptor D1 using [3H]-SCH- 23390 as radioligand				J Med Chem 37: 2686-96 (1994) BindingDB Entry DOI: 10.7270/Q28051NX
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50010597 (1-(5-Isopropylidene-5H-dibenzo[a,d]cyclohepten-10-...) Show SMILES [#6]-[#7]-1-[#6]-[#6]-[#7](-[#6]-[#6]-1)-[#6]-1=[#6]-c2ccccc2\[#6](=[#6](\[#6])-[#6])-c2ccccc-12 |t:8| Show InChI InChI=1S/C23H26N2/c1-17(2)23-19-9-5-4-8-18(19)16-22(20-10-6-7-11-21(20)23)25-14-12-24(3)13-15-25/h4-11,16H,12-15H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	250	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vanderbilt University Curated by ChEMBL					Assay Description Affinity was evaluated by inhibition of [125I]-LSD binding to NIH 3T3 cells transfected with cloned rat 5-hydroxytryptamine 2A receptor				J Med Chem 37: 2686-96 (1994) BindingDB Entry DOI: 10.7270/Q28051NX
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50010597 (1-(5-Isopropylidene-5H-dibenzo[a,d]cyclohepten-10-...) Show SMILES [#6]-[#7]-1-[#6]-[#6]-[#7](-[#6]-[#6]-1)-[#6]-1=[#6]-c2ccccc2\[#6](=[#6](\[#6])-[#6])-c2ccccc-12 |t:8| Show InChI InChI=1S/C23H26N2/c1-17(2)23-19-9-5-4-8-18(19)16-22(20-10-6-7-11-21(20)23)25-14-12-24(3)13-15-25/h4-11,16H,12-15H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	290	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vanderbilt University Curated by ChEMBL					Assay Description Affinity was evaluated by inhibition of [3H]-spiperone binding to COS cells transfected with human dopamine D-2(long) receptor				J Med Chem 37: 2686-96 (1994) BindingDB Entry DOI: 10.7270/Q28051NX
					More data for this Ligand-Target Pair
Serotonin receptor 2a and 2c (5HT2A and 5HT2C) (Rattus norvegicus (Rat))	BDBM50010597 (1-(5-Isopropylidene-5H-dibenzo[a,d]cyclohepten-10-...) Show SMILES [#6]-[#7]-1-[#6]-[#6]-[#7](-[#6]-[#6]-1)-[#6]-1=[#6]-c2ccccc2\[#6](=[#6](\[#6])-[#6])-c2ccccc-12 |t:8| Show InChI InChI=1S/C23H26N2/c1-17(2)23-19-9-5-4-8-18(19)16-22(20-10-6-7-11-21(20)23)25-14-12-24(3)13-15-25/h4-11,16H,12-15H2,1-3H3	KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	390	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vanderbilt University Curated by ChEMBL					Assay Description Affinity of the compound was evaluated by inhibition of [125I]-LSD binding to NIH 3T3 cells transfected with cloned rat 5-hydroxytryptamine 2C recept...				J Med Chem 37: 2686-96 (1994) BindingDB Entry DOI: 10.7270/Q28051NX
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50010597 (1-(5-Isopropylidene-5H-dibenzo[a,d]cyclohepten-10-...) Show SMILES [#6]-[#7]-1-[#6]-[#6]-[#7](-[#6]-[#6]-1)-[#6]-1=[#6]-c2ccccc2\[#6](=[#6](\[#6])-[#6])-c2ccccc-12 |t:8| Show InChI InChI=1S/C23H26N2/c1-17(2)23-19-9-5-4-8-18(19)16-22(20-10-6-7-11-21(20)23)25-14-12-24(3)13-15-25/h4-11,16H,12-15H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vanderbilt University Curated by ChEMBL					Assay Description Affinity was evaluated by inhibition of [3H]-spiperone binding to COS cells transfected with human dopamine D-4 receptor				J Med Chem 37: 2686-96 (1994) BindingDB Entry DOI: 10.7270/Q28051NX
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50010597 (1-(5-Isopropylidene-5H-dibenzo[a,d]cyclohepten-10-...) Show SMILES [#6]-[#7]-1-[#6]-[#6]-[#7](-[#6]-[#6]-1)-[#6]-1=[#6]-c2ccccc2\[#6](=[#6](\[#6])-[#6])-c2ccccc-12 |t:8| Show InChI InChI=1S/C23H26N2/c1-17(2)23-19-9-5-4-8-18(19)16-22(20-10-6-7-11-21(20)23)25-14-12-24(3)13-15-25/h4-11,16H,12-15H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.75E+3	n/a	n/a	n/a	n/a	n/a	n/a
Vanderbilt University Curated by ChEMBL					Assay Description Binding affinity for Dopamine receptor D2 using [3H]-spiperone in rat brain				J Med Chem 33: 809-14 (1990) BindingDB Entry DOI: 10.7270/Q2348JCH
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor (RAT)	BDBM50010597 (1-(5-Isopropylidene-5H-dibenzo[a,d]cyclohepten-10-...) Show SMILES [#6]-[#7]-1-[#6]-[#6]-[#7](-[#6]-[#6]-1)-[#6]-1=[#6]-c2ccccc2\[#6](=[#6](\[#6])-[#6])-c2ccccc-12 |t:8| Show InChI InChI=1S/C23H26N2/c1-17(2)23-19-9-5-4-8-18(19)16-22(20-10-6-7-11-21(20)23)25-14-12-24(3)13-15-25/h4-11,16H,12-15H2,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	415	n/a	n/a	n/a	n/a	n/a	n/a
Vanderbilt University Curated by ChEMBL					Assay Description Binding affinity was determined against Muscarinic acetylcholine receptor using [3H]QNB as radioligand in rat brain.				J Med Chem 33: 809-14 (1990) BindingDB Entry DOI: 10.7270/Q2348JCH
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (RAT)	BDBM50010597 (1-(5-Isopropylidene-5H-dibenzo[a,d]cyclohepten-10-...) Show SMILES [#6]-[#7]-1-[#6]-[#6]-[#7](-[#6]-[#6]-1)-[#6]-1=[#6]-c2ccccc2\[#6](=[#6](\[#6])-[#6])-c2ccccc-12 |t:8| Show InChI InChI=1S/C23H26N2/c1-17(2)23-19-9-5-4-8-18(19)16-22(20-10-6-7-11-21(20)23)25-14-12-24(3)13-15-25/h4-11,16H,12-15H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
Vanderbilt University Curated by ChEMBL					Assay Description Binding affinity against Dopamine receptor D1 using [3H]-SCN 23390 in rat brain				J Med Chem 33: 809-14 (1990) BindingDB Entry DOI: 10.7270/Q2348JCH
					More data for this Ligand-Target Pair