BDBM50354108 CHEMBL1836049

SMILES: COc1cc(cc(OC)c1OC)C(=O)NC1C[C@H]2CC[C@H](C1)N2Cc1ccco1

InChI Key: InChIKey=MYJZXJWVQVVYHK-IAGOWNOFSA-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 = 50354108   

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))	BDBM50354108 (CHEMBL1836049) Show SMILES COc1cc(cc(OC)c1OC)C(=O)NC1C[C@H]2CC[C@H](C1)N2Cc1ccco1 |r,TLB:14:15:22:18.19| Show InChI InChI=1S/C22H28N2O5/c1-26-19-9-14(10-20(27-2)21(19)28-3)22(25)23-15-11-16-6-7-17(12-15)24(16)13-18-5-4-8-29-18/h4-5,8-10,15-17H,6-7,11-13H2,1-3H3,(H,23,25)/t16-,17-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	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))	BDBM50354108 (CHEMBL1836049) Show SMILES COc1cc(cc(OC)c1OC)C(=O)NC1C[C@H]2CC[C@H](C1)N2Cc1ccco1 |r,TLB:14:15:22:18.19| Show InChI InChI=1S/C22H28N2O5/c1-26-19-9-14(10-20(27-2)21(19)28-3)22(25)23-15-11-16-6-7-17(12-15)24(16)13-18-5-4-8-29-18/h4-5,8-10,15-17H,6-7,11-13H2,1-3H3,(H,23,25)/t16-,17-/m1/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.90E+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]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))	BDBM50354108 (CHEMBL1836049) Show SMILES COc1cc(cc(OC)c1OC)C(=O)NC1C[C@H]2CC[C@H](C1)N2Cc1ccco1 |r,TLB:14:15:22:18.19| Show InChI InChI=1S/C22H28N2O5/c1-26-19-9-14(10-20(27-2)21(19)28-3)22(25)23-15-11-16-6-7-17(12-15)24(16)13-18-5-4-8-29-18/h4-5,8-10,15-17H,6-7,11-13H2,1-3H3,(H,23,25)/t16-,17-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.22E+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