Compile Data Set for Download or QSAR

Found 31 hits Enz. Inhib. hit(s) with all data for entry = 50011257   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Potassium channel subfamily K member 10 (Homo sapiens (Human))	BDBM50197060 (CHEMBL1417584) Show SMILES C1CCc2c(C1)cccc2Nc1ccccc1-c1nnn[nH]1 Show InChI InChI=1S/C17H17N5/c1-2-8-13-12(6-1)7-5-11-15(13)18-16-10-4-3-9-14(16)17-19-21-22-20-17/h3-5,7,9-11,18H,1-2,6,8H2,(H,19,20,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	n/a	n/a	7.70E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK2 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 2 (Homo sapiens (Human))	BDBM50546011 (CHEMBL4741659) Show SMILES OC(=O)c1cc(sc1NC(=O)c1ccc(SC(F)(F)F)cc1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.24E+4	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK1 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 10 (Homo sapiens (Human))	BDBM50545999 (CHEMBL4778307) Show SMILES OC(=O)c1cc(F)ccc1NC(=O)c1ccc(SC(F)(F)F)cc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK2 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 10 (Homo sapiens (Human))	BDBM50546000 (CHEMBL4780579) Show SMILES OC(=O)c1ccc(Cl)cc1NC(=O)c1ccc(SC(F)(F)F)cc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	7.50E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK2 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 10 (Homo sapiens (Human))	BDBM50546001 (CHEMBL4776102) Show SMILES OC(=O)c1cc(Cl)ccc1NC(=O)c1ccc(SC(F)(F)F)cc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	6.80E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK2 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 10 (Homo sapiens (Human))	BDBM50546002 (CHEMBL4747631) Show SMILES OC(=O)c1ccc(Br)cc1NC(=O)c1ccc(SC(F)(F)F)cc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	5.90E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK2 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 10 (Homo sapiens (Human))	BDBM50546003 (CHEMBL4759642) Show SMILES OC(=O)c1cc(Br)ccc1NC(=O)c1ccc(SC(F)(F)F)cc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	7.70E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK2 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 10 (Homo sapiens (Human))	BDBM50546004 (CHEMBL4759521) Show SMILES OC(=O)c1cc(Br)c(F)cc1NC(=O)c1ccc(SC(F)(F)F)cc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	5.50E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK2 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 10 (Homo sapiens (Human))	BDBM50546005 (CHEMBL4758530) Show SMILES COc1ccc(C(O)=O)c(NC(=O)c2ccc(SC(F)(F)F)cc2)c1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.85E+4	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK2 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 10 (Homo sapiens (Human))	BDBM50546006 (CHEMBL4747514) Show SMILES COc1ccc(NC(=O)c2ccc(SC(F)(F)F)cc2)c(c1)C(O)=O Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK2 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 10 (Homo sapiens (Human))	BDBM50546007 (CHEMBL4795261) Show SMILES OC(=O)c1cc(OC(F)(F)F)ccc1NC(=O)c1ccc(SC(F)(F)F)cc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	5.60E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK2 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 10 (Homo sapiens (Human))	BDBM50546008 (CHEMBL4784090) Show SMILES OC(=O)c1cc(ccc1NC(=O)c1ccc(SC(F)(F)F)cc1)[N+]([O-])=O Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.65E+4	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK2 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 10 (Homo sapiens (Human))	BDBM50546009 (CHEMBL4750436) Show SMILES OC(=O)c1ccsc1NC(=O)c1ccc(SC(F)(F)F)cc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK2 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 10 (Homo sapiens (Human))	BDBM50546010 (CHEMBL4750599) Show SMILES Cc1sc(NC(=O)c2ccc(SC(F)(F)F)cc2)c(C(O)=O)c1C Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	<3.60E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK2 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 10 (Homo sapiens (Human))	BDBM50546011 (CHEMBL4741659) Show SMILES OC(=O)c1cc(sc1NC(=O)c1ccc(SC(F)(F)F)cc1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK2 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 2 (Homo sapiens (Human))	BDBM50546012 (CHEMBL4761929) Show SMILES O=C(Nc1ccccc1-c1nnn[nH]1)c1ccc2CCCCc2c1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.31E+4	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK1 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 2 (Homo sapiens (Human))	BDBM50197060 (CHEMBL1417584) Show SMILES C1CCc2c(C1)cccc2Nc1ccccc1-c1nnn[nH]1 Show InChI InChI=1S/C17H17N5/c1-2-8-13-12(6-1)7-5-11-15(13)18-16-10-4-3-9-14(16)17-19-21-22-20-17/h3-5,7,9-11,18H,1-2,6,8H2,(H,19,20,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	n/a	n/a	5.20E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK1 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 2 (Homo sapiens (Human))	BDBM50545998 (CHEMBL4745050) Show SMILES OC(=O)c1ccccc1NC(=O)c1ccc(SC(F)(F)F)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.28E+4	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK1 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 2 (Homo sapiens (Human))	BDBM50545999 (CHEMBL4778307) Show SMILES OC(=O)c1cc(F)ccc1NC(=O)c1ccc(SC(F)(F)F)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	9.50E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK1 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 2 (Homo sapiens (Human))	BDBM50546000 (CHEMBL4780579) Show SMILES OC(=O)c1ccc(Cl)cc1NC(=O)c1ccc(SC(F)(F)F)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	4.40E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK1 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 2 (Homo sapiens (Human))	BDBM50546001 (CHEMBL4776102) Show SMILES OC(=O)c1cc(Cl)ccc1NC(=O)c1ccc(SC(F)(F)F)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	3.80E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK1 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 2 (Homo sapiens (Human))	BDBM50546002 (CHEMBL4747631) Show SMILES OC(=O)c1ccc(Br)cc1NC(=O)c1ccc(SC(F)(F)F)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	4.30E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK1 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 2 (Homo sapiens (Human))	BDBM50546003 (CHEMBL4759642) Show SMILES OC(=O)c1cc(Br)ccc1NC(=O)c1ccc(SC(F)(F)F)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	5.90E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK1 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 2 (Homo sapiens (Human))	BDBM50546004 (CHEMBL4759521) Show SMILES OC(=O)c1cc(Br)c(F)cc1NC(=O)c1ccc(SC(F)(F)F)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	6.10E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK1 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 2 (Homo sapiens (Human))	BDBM50546005 (CHEMBL4758530) Show SMILES COc1ccc(C(O)=O)c(NC(=O)c2ccc(SC(F)(F)F)cc2)c1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.65E+4	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK1 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 2 (Homo sapiens (Human))	BDBM50546006 (CHEMBL4747514) Show SMILES COc1ccc(NC(=O)c2ccc(SC(F)(F)F)cc2)c(c1)C(O)=O Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.02E+4	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK1 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 2 (Homo sapiens (Human))	BDBM50546007 (CHEMBL4795261) Show SMILES OC(=O)c1cc(OC(F)(F)F)ccc1NC(=O)c1ccc(SC(F)(F)F)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	4.60E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK1 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 2 (Homo sapiens (Human))	BDBM50546008 (CHEMBL4784090) Show SMILES OC(=O)c1cc(ccc1NC(=O)c1ccc(SC(F)(F)F)cc1)[N+]([O-])=O Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.37E+4	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK1 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 2 (Homo sapiens (Human))	BDBM50546009 (CHEMBL4750436) Show SMILES OC(=O)c1ccsc1NC(=O)c1ccc(SC(F)(F)F)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK1 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 2 (Homo sapiens (Human))	BDBM50546010 (CHEMBL4750599) Show SMILES Cc1sc(NC(=O)c2ccc(SC(F)(F)F)cc2)c(C(O)=O)c1C Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	<3.10E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK1 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair
Potassium channel subfamily K member 10 (Homo sapiens (Human))	BDBM50545998 (CHEMBL4745050) Show SMILES OC(=O)c1ccccc1NC(=O)c1ccc(SC(F)(F)F)cc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human TREK2 by thallium flux mobilization assay				Citation and Details Article DOI: 10.1016/j.bmcl.2019.04.048 BindingDB Entry DOI: 10.7270/Q2XS6006
					More data for this Ligand-Target Pair