BDBM50308013 1-(4-Hydroxyphenyl)-4-{[1-(4-chlorophenyl)-1H-1,2,3-triazol-4-yl]methyl}piperazine::4-(4-((1-(4-chlorophenyl)-1H-1,2,3-triazol-4-yl)methyl)piperazin-1-yl)phenol::CHEMBL597412

SMILES: Oc1ccc(cc1)N1CCN(Cc2cn(nn2)-c2ccc(Cl)cc2)CC1

InChI Key: InChIKey=QOTVTVRIMDVXGS-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 = 50308013   

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 2A (Rattus norvegicus (rat))	BDBM50308013 (1-(4-Hydroxyphenyl)-4-{[1-(4-chlorophenyl)-1H-1,2,...) Show SMILES Oc1ccc(cc1)N1CCN(Cc2cn(nn2)-c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C19H20ClN5O/c20-15-1-3-18(4-2-15)25-14-16(21-22-25)13-23-9-11-24(12-10-23)17-5-7-19(26)8-6-17/h1-8,14,26H,9-13H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>19	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal de Goi£s Curated by ChEMBL					Assay Description Inhibition of [3H]ketanserin binding to 5HT2A receptor in rat cortex membrane at 30 uM				Bioorg Med Chem Lett 20: 2888-91 (2010) Article DOI: 10.1016/j.bmcl.2010.03.034 BindingDB Entry DOI: 10.7270/Q2DB8213
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50308013 (1-(4-Hydroxyphenyl)-4-{[1-(4-chlorophenyl)-1H-1,2,...) Show SMILES Oc1ccc(cc1)N1CCN(Cc2cn(nn2)-c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C19H20ClN5O/c20-15-1-3-18(4-2-15)25-14-16(21-22-25)13-23-9-11-24(12-10-23)17-5-7-19(26)8-6-17/h1-8,14,26H,9-13H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.98E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal do Rio Grande do Sul Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from 5HT1A receptor in Wistar rat hippocampus homogenate				Bioorg Med Chem 18: 1925-35 (2010) Article DOI: 10.1016/j.bmc.2010.01.040 BindingDB Entry DOI: 10.7270/Q2S75H99
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50308013 (1-(4-Hydroxyphenyl)-4-{[1-(4-chlorophenyl)-1H-1,2,...) Show SMILES Oc1ccc(cc1)N1CCN(Cc2cn(nn2)-c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C19H20ClN5O/c20-15-1-3-18(4-2-15)25-14-16(21-22-25)13-23-9-11-24(12-10-23)17-5-7-19(26)8-6-17/h1-8,14,26H,9-13H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal de Goi£s Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5HT1A receptor in rat hippocampal membrane				Bioorg Med Chem Lett 20: 2888-91 (2010) Article DOI: 10.1016/j.bmcl.2010.03.034 BindingDB Entry DOI: 10.7270/Q2DB8213
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50308013 (1-(4-Hydroxyphenyl)-4-{[1-(4-chlorophenyl)-1H-1,2,...) Show SMILES Oc1ccc(cc1)N1CCN(Cc2cn(nn2)-c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C19H20ClN5O/c20-15-1-3-18(4-2-15)25-14-16(21-22-25)13-23-9-11-24(12-10-23)17-5-7-19(26)8-6-17/h1-8,14,26H,9-13H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.92E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal do Rio Grande do Sul Curated by ChEMBL					Assay Description Displacement of [3H]ketanserin from 5HT2A receptor in Wistar rat cortex homogenate				Bioorg Med Chem 18: 1925-35 (2010) Article DOI: 10.1016/j.bmc.2010.01.040 BindingDB Entry DOI: 10.7270/Q2S75H99
					More data for this Ligand-Target Pair