BDBM50448210 CHEMBL3120697::US9018213, 15

SMILES: Fc1ccc2c(noc2c1)C1CCN(CCCCOc2ccc3c4CCCc4c(=O)oc3c2Cl)CC1

InChI Key: InChIKey=ZPSMXADKWDNPGI-UHFFFAOYSA-N

Data: 1 KI  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 3 hits for monomerid = 50448210   

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
Histamine H1 receptor (Cavia porcellus (domestic guinea pig))	BDBM50448210 (CHEMBL3120697 | US9018213, 15) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CCCCOc2ccc3c4CCCc4c(=O)oc3c2Cl)CC1 Show InChI InChI=1S/C28H28ClFN2O4/c29-25-23(9-8-20-19-4-3-5-21(19)28(33)35-27(20)25)34-15-2-1-12-32-13-10-17(11-14-32)26-22-7-6-18(30)16-24(22)36-31-26/h6-9,16-17H,1-5,10-15H2	GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Huazhong University of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]mepyramine from histamine H1 receptor in guinea pig cerebellum homogenate after 60 mins by liquid scintillation counting				Eur J Med Chem 74: 427-39 (2014) Article DOI: 10.1016/j.ejmech.2014.01.012 BindingDB Entry DOI: 10.7270/Q2QR4ZMW
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Rattus norvegicus (Rat))	BDBM50448210 (CHEMBL3120697 | US9018213, 15) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CCCCOc2ccc3c4CCCc4c(=O)oc3c2Cl)CC1 Show InChI InChI=1S/C28H28ClFN2O4/c29-25-23(9-8-20-19-4-3-5-21(19)28(33)35-27(20)25)34-15-2-1-12-32-13-10-17(11-14-32)26-22-7-6-18(30)16-24(22)36-31-26/h6-9,16-17H,1-5,10-15H2	KEGG GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	8.60	n/a	n/a	n/a	n/a	7.4	n/a
Huazhong University of Science & Technology; NHWA Pharma. Corporation US Patent					Assay Description Competitive binding test for receptors: 20 μl of each of the test compounds and 20 μl of the radioactive ligand together with 160 μl o...				US Patent US9018213 (2015) BindingDB Entry DOI: 10.7270/Q27M06N0
					More data for this Ligand-Target Pair
Serotonin receptor 2a and 2c (5HT2A and 5HT2C) (Rattus norvegicus (Rat))	BDBM50448210 (CHEMBL3120697 | US9018213, 15) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CCCCOc2ccc3c4CCCc4c(=O)oc3c2Cl)CC1 Show InChI InChI=1S/C28H28ClFN2O4/c29-25-23(9-8-20-19-4-3-5-21(19)28(33)35-27(20)25)34-15-2-1-12-32-13-10-17(11-14-32)26-22-7-6-18(30)16-24(22)36-31-26/h6-9,16-17H,1-5,10-15H2	KEGG DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.89E+3	n/a	n/a	n/a	n/a	n/a	n/a
Huazhong University of Science & Technology; NHWA Pharma. Corporation US Patent					Assay Description (1) The prepared membrane was first applied with appropriate amount of homogenized liquid, and homogenizer was used for evenly dispersing. 15 tubes w...				US Patent US9018213 (2015) BindingDB Entry DOI: 10.7270/Q27M06N0
					More data for this Ligand-Target Pair