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SMILES: Clc1cc2N(CCc2cc1I)C(=O)Nc1cccnc1

InChI Key: InChIKey=JQICQYRHIKFUGD-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50321871   

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 2C (Homo sapiens (Human))	BDBM50321871 (6-Chloro-5-iodo-2,3-dihydro-indole-1-carboxylic ac...) Show SMILES Clc1cc2N(CCc2cc1I)C(=O)Nc1cccnc1 Show InChI InChI=1S/C14H11ClIN3O/c15-11-7-13-9(6-12(11)16)3-5-19(13)14(20)18-10-2-1-4-17-8-10/h1-2,4,6-8H,3,5H2,(H,18,20)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	3.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of North Texas Health Science Center Curated by ChEMBL					Assay Description Displacement of [3H]mesulergine from human cloned 5HT2C receptor expressed in HEK293 cells after 90 mins by liquid scintillation counting				Bioorg Med Chem 18: 4783-92 (2011) Article DOI: 10.1016/j.bmc.2010.05.017 BindingDB Entry DOI: 10.7270/Q2V69KJ2
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50321871 (6-Chloro-5-iodo-2,3-dihydro-indole-1-carboxylic ac...) Show SMILES Clc1cc2N(CCc2cc1I)C(=O)Nc1cccnc1 Show InChI InChI=1S/C14H11ClIN3O/c15-11-7-13-9(6-12(11)16)3-5-19(13)14(20)18-10-2-1-4-17-8-10/h1-2,4,6-8H,3,5H2,(H,18,20)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	3.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity towards cloned human 5-hydroxytryptamine 2C receptor expressed in HEK 293 cells using [3H]mesulergine as radioligand				J Med Chem 41: 1598-612 (1998) Article DOI: 10.1021/jm970741j BindingDB Entry DOI: 10.7270/Q2WM1H48
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50321871 (6-Chloro-5-iodo-2,3-dihydro-indole-1-carboxylic ac...) Show SMILES Clc1cc2N(CCc2cc1I)C(=O)Nc1cccnc1 Show InChI InChI=1S/C14H11ClIN3O/c15-11-7-13-9(6-12(11)16)3-5-19(13)14(20)18-10-2-1-4-17-8-10/h1-2,4,6-8H,3,5H2,(H,18,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity towards human 5-hydroxytryptamine 2A receptor expressed in HEK 293 cells using [3H]ketanserin as radioligand				J Med Chem 41: 1598-612 (1998) Article DOI: 10.1021/jm970741j BindingDB Entry DOI: 10.7270/Q2WM1H48
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50321871 (6-Chloro-5-iodo-2,3-dihydro-indole-1-carboxylic ac...) Show SMILES Clc1cc2N(CCc2cc1I)C(=O)Nc1cccnc1 Show InChI InChI=1S/C14H11ClIN3O/c15-11-7-13-9(6-12(11)16)3-5-19(13)14(20)18-10-2-1-4-17-8-10/h1-2,4,6-8H,3,5H2,(H,18,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of North Texas Health Science Center Curated by ChEMBL					Assay Description Displacement of [3H]methylspiperone from human cloned 5HT2A receptor expressed in HEK293 cells after 90 mins by liquid scintillation counting				Bioorg Med Chem 18: 4783-92 (2011) Article DOI: 10.1016/j.bmc.2010.05.017 BindingDB Entry DOI: 10.7270/Q2V69KJ2
					More data for this Ligand-Target Pair