BDBM50475177 CHEMBL364495

SMILES: Cc1ccc2c(OCCN3CCN(Cc4ccc(Cl)c(c4)[N+]([O-])=O)CC3)cccc2n1

InChI Key: InChIKey=UNVYWLOYBPSPIR-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 = 50475177   

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 (5-HT) receptor (Homo sapiens (Human))	BDBM50475177 (CHEMBL364495) Show SMILES Cc1ccc2c(OCCN3CCN(Cc4ccc(Cl)c(c4)[N+]([O-])=O)CC3)cccc2n1 Show InChI InChI=1S/C23H25ClN4O3/c1-17-5-7-19-21(25-17)3-2-4-23(19)31-14-13-26-9-11-27(12-10-26)16-18-6-8-20(24)22(15-18)28(29)30/h2-8,15H,9-14,16H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Displacement of [3H]5-HT from human 5-hydroxytryptamine 1D receptor expressed in CHO cells				J Med Chem 48: 3478-80 (2005) Article DOI: 10.1021/jm049039v BindingDB Entry DOI: 10.7270/Q2G73HHF
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50475177 (CHEMBL364495) Show SMILES Cc1ccc2c(OCCN3CCN(Cc4ccc(Cl)c(c4)[N+]([O-])=O)CC3)cccc2n1 Show InChI InChI=1S/C23H25ClN4O3/c1-17-5-7-19-21(25-17)3-2-4-23(19)31-14-13-26-9-11-27(12-10-26)16-18-6-8-20(24)22(15-18)28(29)30/h2-8,15H,9-14,16H2,1H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	63	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Displacement of [3H]WAY-100635 from human 5-hydroxytryptamine 1A receptor expressed in CHO cells				J Med Chem 48: 3478-80 (2005) Article DOI: 10.1021/jm049039v BindingDB Entry DOI: 10.7270/Q2G73HHF
					More data for this Ligand-Target Pair
Serotonin (5-HT) receptor (Homo sapiens (Human))	BDBM50475177 (CHEMBL364495) Show SMILES Cc1ccc2c(OCCN3CCN(Cc4ccc(Cl)c(c4)[N+]([O-])=O)CC3)cccc2n1 Show InChI InChI=1S/C23H25ClN4O3/c1-17-5-7-19-21(25-17)3-2-4-23(19)31-14-13-26-9-11-27(12-10-26)16-18-6-8-20(24)22(15-18)28(29)30/h2-8,15H,9-14,16H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Displacement of [3H]5-HT from human 5-hydroxytryptamine 1B receptor expressed in CHO cells				J Med Chem 48: 3478-80 (2005) Article DOI: 10.1021/jm049039v BindingDB Entry DOI: 10.7270/Q2G73HHF
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50475177 (CHEMBL364495) Show SMILES Cc1ccc2c(OCCN3CCN(Cc4ccc(Cl)c(c4)[N+]([O-])=O)CC3)cccc2n1 Show InChI InChI=1S/C23H25ClN4O3/c1-17-5-7-19-21(25-17)3-2-4-23(19)31-14-13-26-9-11-27(12-10-26)16-18-6-8-20(24)22(15-18)28(29)30/h2-8,15H,9-14,16H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of [3H]5-HT binding to serotonin transporter in rat cortical synaptosomes				J Med Chem 48: 3478-80 (2005) Article DOI: 10.1021/jm049039v BindingDB Entry DOI: 10.7270/Q2G73HHF
					More data for this Ligand-Target Pair