BDBM50130090 9-Chloro-7-(2-fluoro-phenyl)-2,3,4,5,11,11a-hexahydro-1H-[1,4]diazepino[1,7-a]indole::CHEMBL310844

SMILES: Fc1ccccc1-c1cc(Cl)cc2CC3CCNCCN3c12

InChI Key: InChIKey=WXBGLLVFVWSXON-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50130090   

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 (Homo sapiens (Human))	BDBM50130090 (9-Chloro-7-(2-fluoro-phenyl)-2,3,4,5,11,11a-hexahy...) Show SMILES Fc1ccccc1-c1cc(Cl)cc2CC3CCNCCN3c12 Show InChI InChI=1S/C18H18ClFN2/c19-13-9-12-10-14-5-6-21-7-8-22(14)18(12)16(11-13)15-3-1-2-4-17(15)20/h1-4,9,11,14,21H,5-8,10H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	141	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmacia Corporation Curated by ChEMBL					Assay Description Binding affinity against 5-hydroxytryptamine 2A receptor using [125I]-DOI radioligand.				Bioorg Med Chem Lett 13: 2369-72 (2003) BindingDB Entry DOI: 10.7270/Q2B857GJ
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50130090 (9-Chloro-7-(2-fluoro-phenyl)-2,3,4,5,11,11a-hexahy...) Show SMILES Fc1ccccc1-c1cc(Cl)cc2CC3CCNCCN3c12 Show InChI InChI=1S/C18H18ClFN2/c19-13-9-12-10-14-5-6-21-7-8-22(14)18(12)16(11-13)15-3-1-2-4-17(15)20/h1-4,9,11,14,21H,5-8,10H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	223	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmacia Corporation Curated by ChEMBL					Assay Description Binding affinity against 5-hydroxytryptamine 2C receptor using [125I]-DOI radioligand.				Bioorg Med Chem Lett 13: 2369-72 (2003) BindingDB Entry DOI: 10.7270/Q2B857GJ
					More data for this Ligand-Target Pair