BDBM152816 US8993575, 6

SMILES: Fc1ccc2c(noc2c1)C1CCN(CCCSc2nnc(o2)-c2ccc(Cl)cc2)CC1

InChI Key: InChIKey=QIGIRCWITRQCMF-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 = 152816   

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))	BDBM152816 (US8993575, 6) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CCCSc2nnc(o2)-c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C23H22ClFN4O2S/c24-17-4-2-16(3-5-17)22-26-27-23(30-22)32-13-1-10-29-11-8-15(9-12-29)21-19-7-6-18(25)14-20(19)31-28-21/h2-7,14-15H,1,8-13H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	15.1	n/a	n/a	n/a	n/a	7.5	n/a
Huazhong University of Science & Technology; NHWA Pharma Corporation US Patent					Assay Description Materials for the Receptor Binding AssayIsotope ligand [3H]-Ketanserin (67.0 Ci/mmol) was purchased from PerkinElmer Company; Methysergide was purcha...				US Patent US8993575 (2015) BindingDB Entry DOI: 10.7270/Q2RX99TN
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM152816 (US8993575, 6) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CCCSc2nnc(o2)-c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C23H22ClFN4O2S/c24-17-4-2-16(3-5-17)22-26-27-23(30-22)32-13-1-10-29-11-8-15(9-12-29)21-19-7-6-18(25)14-20(19)31-28-21/h2-7,14-15H,1,8-13H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	19.9	n/a	n/a	n/a	n/a	n/a	n/a
Huazhong University of Science & Technology; NHWA Pharma Corporation US Patent					Assay Description Isotope ligand 3H-8-OH-DPAT (67.0 Ci/mmol) was purchased from PerkinElmer Company; 5-HT was purchased from RBI Company; GF/C glass fiber filter paper...				US Patent US8993575 (2015) BindingDB Entry DOI: 10.7270/Q2RX99TN
					More data for this Ligand-Target Pair