BDBM50040246 3-Methyl-6-(4-methyl-piperazin-1-yl)-11H-benzo[e]pyrido[3,2-b][1,4]diazepine::CHEMBL63590

SMILES: CN1CCN(CC1)C1=Nc2cc(C)cnc2Nc2ccccc12

InChI Key: InChIKey=XLWWTPXFRQGJOE-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50040246   

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 2 (5-HT2) receptor (Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)	BDBM50040246 (3-Methyl-6-(4-methyl-piperazin-1-yl)-11H-benzo[e]p...) Show SMILES CN1CCN(CC1)C1=Nc2cc(C)cnc2Nc2ccccc12 |t:8| Show InChI InChI=1S/C18H21N5/c1-13-11-16-17(19-12-13)20-15-6-4-3-5-14(15)18(21-16)23-9-7-22(2)8-10-23/h3-6,11-12H,7-10H2,1-2H3,(H,19,20)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	103	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Liège Curated by ChEMBL					Assay Description In vitro binding affinity against rat 5-hydroxytryptamine 2 receptor.				J Med Chem 36: 2107-14 (1993) BindingDB Entry DOI: 10.7270/Q22B8X37
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50040246 (3-Methyl-6-(4-methyl-piperazin-1-yl)-11H-benzo[e]p...) Show SMILES CN1CCN(CC1)C1=Nc2cc(C)cnc2Nc2ccccc12 |t:8| Show InChI InChI=1S/C18H21N5/c1-13-11-16-17(19-12-13)20-15-6-4-3-5-14(15)18(21-16)23-9-7-22(2)8-10-23/h3-6,11-12H,7-10H2,1-2H3,(H,19,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	297	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Liège Curated by ChEMBL					Assay Description In vitro binding affinity against Dopamine D2 receptor in rat striatal tissue.				J Med Chem 36: 2107-14 (1993) BindingDB Entry DOI: 10.7270/Q22B8X37
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor (RAT)	BDBM50040246 (3-Methyl-6-(4-methyl-piperazin-1-yl)-11H-benzo[e]p...) Show SMILES CN1CCN(CC1)C1=Nc2cc(C)cnc2Nc2ccccc12 |t:8| Show InChI InChI=1S/C18H21N5/c1-13-11-16-17(19-12-13)20-15-6-4-3-5-14(15)18(21-16)23-9-7-22(2)8-10-23/h3-6,11-12H,7-10H2,1-2H3,(H,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	523	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Liège Curated by ChEMBL					Assay Description In vitro binding affinity against Muscarinic acetylcholine receptors in rat brain.				J Med Chem 36: 2107-14 (1993) BindingDB Entry DOI: 10.7270/Q22B8X37
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (RAT)	BDBM50040246 (3-Methyl-6-(4-methyl-piperazin-1-yl)-11H-benzo[e]p...) Show SMILES CN1CCN(CC1)C1=Nc2cc(C)cnc2Nc2ccccc12 |t:8| Show InChI InChI=1S/C18H21N5/c1-13-11-16-17(19-12-13)20-15-6-4-3-5-14(15)18(21-16)23-9-7-22(2)8-10-23/h3-6,11-12H,7-10H2,1-2H3,(H,19,20)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.14E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Liège Curated by ChEMBL					Assay Description In vitro binding affinity against Dopamine receptor D1 in rat striatal tissue				J Med Chem 36: 2107-14 (1993) BindingDB Entry DOI: 10.7270/Q22B8X37
					More data for this Ligand-Target Pair