BDBM50083665 4-(Benzylamino-methyl)-1-[3-(5-[1,2,4]triazol-4-yl-1H-indol-3-yl)-propyl]-piperidin-4-ol::CHEMBL326125

SMILES: OC1(CNCc2ccccc2)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1

InChI Key: InChIKey=XYDQALICSDUWGB-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50083665   

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 1B (Homo sapiens (Human))	BDBM50083665 (4-(Benzylamino-methyl)-1-[3-(5-[1,2,4]triazol-4-yl...) Show SMILES OC1(CNCc2ccccc2)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1 Show InChI InChI=1S/C26H32N6O/c33-26(18-27-16-21-5-2-1-3-6-21)10-13-31(14-11-26)12-4-7-22-17-28-25-9-8-23(15-24(22)25)32-19-29-30-20-32/h1-3,5-6,8-9,15,17,19-20,27-28,33H,4,7,10-14,16,18H2	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	47	n/a	n/a	n/a	n/a	n/a	n/a
Merck, Sharp & Dohme Research Laboratories Curated by ChEMBL					Assay Description Ability to displace [3H]-5-HT from recombinant human 5-hydroxytryptamine 1B receptor stably expressed in CHO cells determined in vitro				Bioorg Med Chem Lett 9: 3369-74 (2000) BindingDB Entry DOI: 10.7270/Q22F7MNB
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50083665 (4-(Benzylamino-methyl)-1-[3-(5-[1,2,4]triazol-4-yl...) Show SMILES OC1(CNCc2ccccc2)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1 Show InChI InChI=1S/C26H32N6O/c33-26(18-27-16-21-5-2-1-3-6-21)10-13-31(14-11-26)12-4-7-22-17-28-25-9-8-23(15-24(22)25)32-19-29-30-20-32/h1-3,5-6,8-9,15,17,19-20,27-28,33H,4,7,10-14,16,18H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	0.450	n/a	n/a	n/a	n/a	n/a	n/a
Merck, Sharp & Dohme Research Laboratories Curated by ChEMBL					Assay Description Ability to displace [3H]-5-HT from recombinant human 5-hydroxytryptamine 1D receptor stably expressed in CHO cells determined in vitro				Bioorg Med Chem Lett 9: 3369-74 (2000) BindingDB Entry DOI: 10.7270/Q22F7MNB
					More data for this Ligand-Target Pair