BDBM50329662 3-(3,3-dimethylbut-1-ynyl)-6-(5,5-dimethylhex-1-en-2-yl)-9H-fluorene::CHEMBL1270143

SMILES: C[Si](C)(C)C#Cc1ccc2[nH]c3cnc(cc3c2c1)C(=O)OCC(F)(F)F

InChI Key: InChIKey=AYRJXCIMSHQLPG-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 50329662   

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
GABA receptor alpha-1/beta-3/gamma-2 subunit (Homo sapiens (Human))	BDBM50329662 (3-(3,3-dimethylbut-1-ynyl)-6-(5,5-dimethylhex-1-en...) Show SMILES C[Si](C)(C)C#Cc1ccc2[nH]c3cnc(cc3c2c1)C(=O)OCC(F)(F)F Show InChI InChI=1S/C19H17F3N2O2Si/c1-27(2,3)7-6-12-4-5-15-13(8-12)14-9-16(23-10-17(14)24-15)18(25)26-11-19(20,21)22/h4-5,8-10,24H,11H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Displacement of [3H]flunitrazepam from human recombinant GABAA alpha1beta3gamma2 receptor expressed in HEK cells by liquid scintillation counting				Bioorg Med Chem 18: 7548-64 (2010) Article DOI: 10.1016/j.bmc.2010.08.049 BindingDB Entry DOI: 10.7270/Q2G1613B
					More data for this Ligand-Target Pair
GABA receptor alpha-2/beta-3/gamma-2 subunit (Homo sapiens (Human))	BDBM50329662 (3-(3,3-dimethylbut-1-ynyl)-6-(5,5-dimethylhex-1-en...) Show SMILES C[Si](C)(C)C#Cc1ccc2[nH]c3cnc(cc3c2c1)C(=O)OCC(F)(F)F Show InChI InChI=1S/C19H17F3N2O2Si/c1-27(2,3)7-6-12-4-5-15-13(8-12)14-9-16(23-10-17(14)24-15)18(25)26-11-19(20,21)22/h4-5,8-10,24H,11H2,1-3H3	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	59	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Displacement of [3H]flunitrazepam from human recombinant GABAA alpha2beta3gamma2 receptor expressed in HEK cells by liquid scintillation counting				Bioorg Med Chem 18: 7548-64 (2010) Article DOI: 10.1016/j.bmc.2010.08.049 BindingDB Entry DOI: 10.7270/Q2G1613B
					More data for this Ligand-Target Pair
GABA receptor alpha-3/beta-3/gamma-2 subunit (Homo sapiens (Human))	BDBM50329662 (3-(3,3-dimethylbut-1-ynyl)-6-(5,5-dimethylhex-1-en...) Show SMILES C[Si](C)(C)C#Cc1ccc2[nH]c3cnc(cc3c2c1)C(=O)OCC(F)(F)F Show InChI InChI=1S/C19H17F3N2O2Si/c1-27(2,3)7-6-12-4-5-15-13(8-12)14-9-16(23-10-17(14)24-15)18(25)26-11-19(20,21)22/h4-5,8-10,24H,11H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	88	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Displacement of [3H]flunitrazepam from human recombinant GABAA alpha3beta3gamma2 receptor expressed in HEK cells by liquid scintillation counting				Bioorg Med Chem 18: 7548-64 (2010) Article DOI: 10.1016/j.bmc.2010.08.049 BindingDB Entry DOI: 10.7270/Q2G1613B
					More data for this Ligand-Target Pair
GABA receptor alpha-4/beta-3/gamma-2 subunit (Homo sapiens (Human))	BDBM50329662 (3-(3,3-dimethylbut-1-ynyl)-6-(5,5-dimethylhex-1-en...) Show SMILES C[Si](C)(C)C#Cc1ccc2[nH]c3cnc(cc3c2c1)C(=O)OCC(F)(F)F Show InChI InChI=1S/C19H17F3N2O2Si/c1-27(2,3)7-6-12-4-5-15-13(8-12)14-9-16(23-10-17(14)24-15)18(25)26-11-19(20,21)22/h4-5,8-10,24H,11H2,1-3H3	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Displacement of [3H]flunitrazepam from human recombinant GABAA alpha4beta3gamma2 receptor expressed in HEK cells by liquid scintillation counting				Bioorg Med Chem 18: 7548-64 (2010) Article DOI: 10.1016/j.bmc.2010.08.049 BindingDB Entry DOI: 10.7270/Q2G1613B
					More data for this Ligand-Target Pair
GABA receptor alpha-5/beta-3/gamma-2 subunit (Homo sapiens (Human))	BDBM50329662 (3-(3,3-dimethylbut-1-ynyl)-6-(5,5-dimethylhex-1-en...) Show SMILES C[Si](C)(C)C#Cc1ccc2[nH]c3cnc(cc3c2c1)C(=O)OCC(F)(F)F Show InChI InChI=1S/C19H17F3N2O2Si/c1-27(2,3)7-6-12-4-5-15-13(8-12)14-9-16(23-10-17(14)24-15)18(25)26-11-19(20,21)22/h4-5,8-10,24H,11H2,1-3H3	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.44E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Displacement of [3H]flunitrazepam from human recombinant GABAA alpha5beta3gamma2 receptor expressed in HEK cells by liquid scintillation counting				Bioorg Med Chem 18: 7548-64 (2010) Article DOI: 10.1016/j.bmc.2010.08.049 BindingDB Entry DOI: 10.7270/Q2G1613B
					More data for this Ligand-Target Pair
GABA receptor alpha-6/beta-3/gamma-2 subunit (Homo sapiens (Human))	BDBM50329662 (3-(3,3-dimethylbut-1-ynyl)-6-(5,5-dimethylhex-1-en...) Show SMILES C[Si](C)(C)C#Cc1ccc2[nH]c3cnc(cc3c2c1)C(=O)OCC(F)(F)F Show InChI InChI=1S/C19H17F3N2O2Si/c1-27(2,3)7-6-12-4-5-15-13(8-12)14-9-16(23-10-17(14)24-15)18(25)26-11-19(20,21)22/h4-5,8-10,24H,11H2,1-3H3	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Displacement of [3H]flunitrazepam from human recombinant GABAA alpha6beta3gamma2 receptor expressed in HEK cells by liquid scintillation counting				Bioorg Med Chem 18: 7548-64 (2010) Article DOI: 10.1016/j.bmc.2010.08.049 BindingDB Entry DOI: 10.7270/Q2G1613B
					More data for this Ligand-Target Pair