BDBM50125162 CHEMBL162102::N-[5-Fluoro-2-((7bS,11aR)-4-6,7,8,9,11,11a-hexahydro-5H,7bH-4-thia-7a,10-diaza-cyclohepta[jk]fluoren-10-yl-butyryl)-phenyl]-methanesulfonamide

SMILES: CS(=O)(=O)Nc1cc(F)ccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3SCCCN2c13

InChI Key: InChIKey=DJAYOTFCMKFULR-UNMCSNQZSA-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 = 50125162   

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))	BDBM50125162 (CHEMBL162102 | N-[5-Fluoro-2-((7bS,11aR)-4-6,7,8,9...) Show SMILES CS(=O)(=O)Nc1cc(F)ccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3SCCCN2c13 Show InChI InChI=1S/C25H30FN3O3S2/c1-34(31,32)27-21-15-17(26)8-9-19(21)23(30)6-3-11-28-13-10-22-20(16-28)18-5-2-7-24-25(18)29(22)12-4-14-33-24/h2,5,7-9,15,20,22,27H,3-4,6,10-14,16H2,1H3/t20-,22-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	7.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Binding affinity towards 5-hydroxytryptamine 2A receptor using [125I]-DOI as radioligand.				Bioorg Med Chem Lett 13: 767-70 (2003) BindingDB Entry DOI: 10.7270/Q25H7FNW
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50125162 (CHEMBL162102 | N-[5-Fluoro-2-((7bS,11aR)-4-6,7,8,9...) Show SMILES CS(=O)(=O)Nc1cc(F)ccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3SCCCN2c13 Show InChI InChI=1S/C25H30FN3O3S2/c1-34(31,32)27-21-15-17(26)8-9-19(21)23(30)6-3-11-28-13-10-22-20(16-28)18-5-2-7-24-25(18)29(22)12-4-14-33-24/h2,5,7-9,15,20,22,27H,3-4,6,10-14,16H2,1H3/t20-,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Binding affinity towards DA D2 receptor using [3H]-N-methyl-spiperone as radioligand.				Bioorg Med Chem Lett 13: 767-70 (2003) BindingDB Entry DOI: 10.7270/Q25H7FNW
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50125162 (CHEMBL162102 | N-[5-Fluoro-2-((7bS,11aR)-4-6,7,8,9...) Show SMILES CS(=O)(=O)Nc1cc(F)ccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3SCCCN2c13 Show InChI InChI=1S/C25H30FN3O3S2/c1-34(31,32)27-21-15-17(26)8-9-19(21)23(30)6-3-11-28-13-10-22-20(16-28)18-5-2-7-24-25(18)29(22)12-4-14-33-24/h2,5,7-9,15,20,22,27H,3-4,6,10-14,16H2,1H3/t20-,22-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	639	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Binding affinity towards 5-hydroxytryptamine 2C receptor using [125I]-DOI as radioligand.				Bioorg Med Chem Lett 13: 767-70 (2003) BindingDB Entry DOI: 10.7270/Q25H7FNW
					More data for this Ligand-Target Pair