BDBM50354097 CHEMBL1836060

SMILES: COc1ccc(F)cc1C(=O)NC1C[C@H]2CC[C@H](C1)N2CC1CCCO1

InChI Key: InChIKey=RMYJHKWCNASDMS-YNPPLXCJSA-N

Data: 3 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 3 hits for monomerid = 50354097   

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))	BDBM50354097 (CHEMBL1836060) Show SMILES COc1ccc(F)cc1C(=O)NC1C[C@H]2CC[C@H](C1)N2CC1CCCO1 |r,TLB:11:12:19:15.16| Show InChI InChI=1S/C20H27FN2O3/c1-25-19-7-4-13(21)9-18(19)20(24)22-14-10-15-5-6-16(11-14)23(15)12-17-3-2-8-26-17/h4,7,9,14-17H,2-3,5-6,8,10-12H2,1H3,(H,22,24)/t15-,16-,17?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]ketanserin from 5HT2A in rat brain cerebral cortex after 20 mins by scintillation counting				Eur J Med Chem 46: 4474-88 (2011) Article DOI: 10.1016/j.ejmech.2011.07.022 BindingDB Entry DOI: 10.7270/Q2Z0395D
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50354097 (CHEMBL1836060) Show SMILES COc1ccc(F)cc1C(=O)NC1C[C@H]2CC[C@H](C1)N2CC1CCCO1 |r,TLB:11:12:19:15.16| Show InChI InChI=1S/C20H27FN2O3/c1-25-19-7-4-13(21)9-18(19)20(24)22-14-10-15-5-6-16(11-14)23(15)12-17-3-2-8-26-17/h4,7,9,14-17H,2-3,5-6,8,10-12H2,1H3,(H,22,24)/t15-,16-,17?/m1/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.01E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8OH-DPAT from 5HT1A in rat brain cerebral cortex after 15 mins by scintillation counting				Eur J Med Chem 46: 4474-88 (2011) Article DOI: 10.1016/j.ejmech.2011.07.022 BindingDB Entry DOI: 10.7270/Q2Z0395D
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50354097 (CHEMBL1836060) Show SMILES COc1ccc(F)cc1C(=O)NC1C[C@H]2CC[C@H](C1)N2CC1CCCO1 |r,TLB:11:12:19:15.16| Show InChI InChI=1S/C20H27FN2O3/c1-25-19-7-4-13(21)9-18(19)20(24)22-14-10-15-5-6-16(11-14)23(15)12-17-3-2-8-26-17/h4,7,9,14-17H,2-3,5-6,8,10-12H2,1H3,(H,22,24)/t15-,16-,17?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.24E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from dopamine D2 receptor in rat straitum tissue after 20 mins by scintillation counting				Eur J Med Chem 46: 4474-88 (2011) Article DOI: 10.1016/j.ejmech.2011.07.022 BindingDB Entry DOI: 10.7270/Q2Z0395D
					More data for this Ligand-Target Pair