BDBM50504828 CHEMBL4464881

SMILES: COc1cccc(c1)-c1ccc(CNCCc2c[nH]c3ccc(OC)cc23)o1

InChI Key: InChIKey=PSIVUIKUCMHEPP-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 = 50504828   

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
5-hydroxytryptamine receptor 6 (Homo sapiens (Human))	BDBM50504828 (CHEMBL4464881) Show SMILES COc1cccc(c1)-c1ccc(CNCCc2c[nH]c3ccc(OC)cc23)o1 Show InChI InChI=1S/C23H24N2O3/c1-26-18-5-3-4-16(12-18)23-9-7-20(28-23)15-24-11-10-17-14-25-22-8-6-19(27-2)13-21(17)22/h3-9,12-14,24-25H,10-11,15H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	76	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Polish Academy of Sciences Curated by ChEMBL					Assay Description Displacement of [3H]-LSD from human 5-HT6R expressed in HEK293 cells after 1 hr by microbeta plate reader analysis				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111857
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50504828 (CHEMBL4464881) Show SMILES COc1cccc(c1)-c1ccc(CNCCc2c[nH]c3ccc(OC)cc23)o1 Show InChI InChI=1S/C23H24N2O3/c1-26-18-5-3-4-16(12-18)23-9-7-20(28-23)15-24-11-10-17-14-25-22-8-6-19(27-2)13-21(17)22/h3-9,12-14,24-25H,10-11,15H2,1-2H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	91	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Polish Academy of Sciences Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in HEK293 cells after 1 hr by microbeta plate reader analysis				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111857
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50504828 (CHEMBL4464881) Show SMILES COc1cccc(c1)-c1ccc(CNCCc2c[nH]c3ccc(OC)cc23)o1 Show InChI InChI=1S/C23H24N2O3/c1-26-18-5-3-4-16(12-18)23-9-7-20(28-23)15-24-11-10-17-14-25-22-8-6-19(27-2)13-21(17)22/h3-9,12-14,24-25H,10-11,15H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	216	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Polish Academy of Sciences Curated by ChEMBL					Assay Description Binding affinity to human 5-HT2AR expressed in HEK293 cells by competitive binding assay				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111857
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50504828 (CHEMBL4464881) Show SMILES COc1cccc(c1)-c1ccc(CNCCc2c[nH]c3ccc(OC)cc23)o1 Show InChI InChI=1S/C23H24N2O3/c1-26-18-5-3-4-16(12-18)23-9-7-20(28-23)15-24-11-10-17-14-25-22-8-6-19(27-2)13-21(17)22/h3-9,12-14,24-25H,10-11,15H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	871	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Polish Academy of Sciences Curated by ChEMBL					Assay Description Displacement of [3H]-CT from human 5-HT7 receptor expressed in HEK293 cells after 1 hr by microbeta plate reader analysis				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111857
					More data for this Ligand-Target Pair