Compile Data Set for Download or QSAR

Found 223 hits with Last Name = 'ostenfeld' and Initial = 't'   

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
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578497 (US11479539, Compound 16) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1ccc(C)nc1 |w:2.1,c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	660	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578498 (US11479539, Compound 17) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1ccc(C)cc1 |w:2.1,c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	309	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578499 (US11479539, Compound 18) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1cccnc1Cl |w:2.1,c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	265	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578500 (US11479539, Compound 19) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1ccccc1C(F)(F)F |w:2.1,c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	1.24E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578501 (US11479539, Compound 20) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1cccc(n1)C(F)(F)F |w:2.1,c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	126	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578502 (US11479539, Compound 21) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1cccnc1Br |w:2.1,c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	452	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578503 (US11479539, Compound 22) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1ncccc1Br |w:2.1,c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	45	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50502729 (CHEMBL4593124 | US11479539, Compound 23) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1ncccc1-c1cnn(C)c1 |c:9| Show InChI InChI=1S/C19H20N4O2/c1-18(2)12-19(25-4,8-13(9-20)17(18)24)16-15(6-5-7-21-16)14-10-22-23(3)11-14/h5-8,10-11H,12H2,1-4H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	56	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578505 (US11479539, Compound 24) Show SMILES CC1(C)CC(O)(C=C(C#N)C1=O)c1ccc(cn1)C(F)(F)F |w:4.4,t:6| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578506 (US11479539, Compound 25) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1cccnc1-c1cnn(C)c1 |w:2.1,c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	70	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578507 (3-(5-fluoro-3- (trifluoromethyl)py- ridin-2-yl)-3-...) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1ncc(F)cc1C(F)(F)F |c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	24	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578508 (3-(5- fluoropyridin-2- yl)-3-methoxy- 5,5-dimethyl...) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1ccc(F)cn1 |c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	180	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578509 (3-(3,5- difluoropyridin-2- yl)-3-methoxy- 5,5-dime...) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1ncc(F)cc1F |c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	36	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578510 (3-(2,6- dimethylpyridin- 3-yl)-3-methoxy- 5,5-dime...) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1ccc(C)nc1C |c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	91	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578511 (3-methoxy-5,5- dimethyl-3-(6- methylpyrazin-2- yl)...) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1cncc(C)n1 |c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	458	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578512 (3-(5-fluoro-3- methylpyridin-2- yl)-3-methoxy- 5,5...) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1ncc(F)cc1C |c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	19	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578513 (3-(5- chloropyridin-2- yl)-3-methoxy- 5,5-dimethyl...) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1ccc(Cl)cn1 |c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	55	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578514 (3-methoxy-5,5- dimethyl-6-oxo- 3-(4-(tri- fluorome...) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1nc(cs1)C(F)(F)F |c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	383	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578515 (3-methoxy-5,5- dimethyl-3-(3- methylthiophen- 2-yl...) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1sccc1C |c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	12	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578516 (3-ethoxy-5,5- dimethyl-6-oxo- 3-(3- (trifluorometh...) Show SMILES CCOC1(CC(C)(C)C(=O)C(=C1)C#N)c1ncccc1C(F)(F)F |c:10| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	39	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578517 (3-methoxy-5,5- dimethyl-3-(4- methylthiazol-2- yl)...) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1nc(C)cs1 |c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	96	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578518 (3-ethoxy-3-(5- fluoropyridin-2- yl)-5,5-dimethyl- ...) Show SMILES CCOC1(CC(C)(C)C(=O)C(=C1)C#N)c1ccc(F)cn1 |c:10| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	86	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578519 ((S)-3-methoxy- 5,5-dimethyl-3- (5-methylthiazol- 4...) Show SMILES CO[C@]1(CC(C)(C)C(=O)C(=C1)C#N)c1ncsc1C |r,c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	132	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578520 (3-methoxy-5,5- dimethyl-6-oxo- 3-(thiazol-2- yl)cy...) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1nccs1 |c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	125	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578521 ((S)-3-methoxy- 5,5-dimethyl-3- (5-methylthiazol- 2...) Show SMILES CO[C@]1(CC(C)(C)C(=O)C(=C1)C#N)c1ncc(C)s1 |r,c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	38	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578522 (3-methoxy-5,5- dimethyl-6-oxo- 3-(3- (trifluoromet...) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1ncccc1OC(F)(F)F |c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	11	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50502734 (CHEMBL4442320 | US11479539, Compound 42) Show SMILES CO[C@]1(CC(C)(C)C(=O)C(=C1)C#N)c1ncc(F)cc1C(F)F |r,c:9| Show InChI InChI=1S/C16H15F3N2O2/c1-15(2)8-16(23-3,5-9(6-20)13(15)22)12-11(14(18)19)4-10(17)7-21-12/h4-5,7,14H,8H2,1-3H3/t16-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	33	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578524 (3-methoxy-5,5- dimethyl-3-(4- methylthiazol-5- yl)...) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1scnc1C |c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	129	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578509 (3-(3,5- difluoropyridin-2- yl)-3-methoxy- 5,5-dime...) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1ncc(F)cc1F |c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	37	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578526 (3-(5-chloro-3- (difluoromethyl)py- ridin-2-yl)-3- ...) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1ncc(Cl)cc1C(F)F |c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	28	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578527 (3-(2,4- dimethylthiazol- 5-yl)-3-methoxy- 5,5-dime...) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1sc(C)nc1C |c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	304	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50502728 (CHEMBL4542755 | US11479539, Compound 174) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1ncc(F)cc1OC(F)F |c:9| Show InChI InChI=1S/C16H15F3N2O3/c1-15(2)8-16(23-3,5-9(6-20)13(15)22)12-11(24-14(18)19)4-10(17)7-21-12/h4-5,7,14H,8H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	8	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50502727 (CHEMBL4584154 | US11479539, Compound 48) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1ncc(F)cc1Br |c:9| Show InChI InChI=1S/C15H14BrFN2O2/c1-14(2)8-15(21-3,5-9(6-18)13(14)20)12-11(16)4-10(17)7-19-12/h4-5,7H,8H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	6	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578530 (US11479539, Compound 126 | US11479539, Compound 49) Show SMILES COC1(CC2(CC2)C(=O)C(=C1)C#N)c1cccc(n1)-c1cnn(C)c1 |c:10| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	138	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578531 (7-methoxy-7-(6- (2- methylpyrimidin- 5-yl)pyridin-...) Show SMILES COC1(CC2(CC2)C(=O)C(=C1)C#N)c1cccc(n1)-c1cnc(C)nc1 |c:10| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	30	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578532 (7-methoxy-4- oxo-7-(6- (pyrimidin-5- yl)pyridin-2-...) Show SMILES COC1(CC2(CC2)C(=O)C(=C1)C#N)c1cccc(n1)-c1cncnc1 |c:10| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	48	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578533 (7-(6-(3,5- dimethylisoxazol- 4-yl)pyridin-2- yl)-7...) Show SMILES COC1(CC2(CC2)C(=O)C(=C1)C#N)c1cccc(n1)-c1c(C)noc1C |c:10| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	74	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578534 (7-methoxy-7-(6- (1-methyl-1H- pyrazol-5- yl)pyridi...) Show SMILES COC1(CC2(CC2)C(=O)C(=C1)C#N)c1cccc(n1)-c1ccnn1C |c:10| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	133	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578535 (US11479539, Compound 131 | US11479539, Compound 54) Show SMILES COC1(CC2(CC2)C(=O)C(=C1)C#N)c1cncc(C)n1 |c:10| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	363	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50502726 (CHEMBL4583328 | US11479539, Compound 55) Show SMILES CO[C@]1(CC2(CC2)C(=O)C(=C1)C#N)c1ncccc1C(F)F |r,c:10| Show InChI InChI=1S/C16H14F2N2O2/c1-22-16(12-11(14(17)18)3-2-6-20-12)7-10(8-19)13(21)15(9-16)4-5-15/h2-3,6-7,14H,4-5,9H2,1H3/t16-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	14	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578491 (US11479539, Compound 10) Show SMILES CCc1cccc(n1)C1(CC(C)(C)C(=O)C(=C1)C#N)OC |w:8.20,c:16| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578492 (US11479539, Compound 11) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1ccccn1 |w:2.1,c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	85	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578493 (US11479539, Compound 12) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1cccc(n1)-n1ccnc1C |w:2.1,c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	119	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578494 (US11479539, Compound 13) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1cccc(n1)-c1ccccc1 |w:2.1,c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578495 (US11479539, Compound 107 | US11479539, Compound 11...) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1cccc(n1)-c1cnn(C)c1 |c:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	12	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50502724 (CHEMBL4463989 | US11479539, Compound 122) Show SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1ncccc1C(F)(F)F |c:9| Show InChI InChI=1S/C16H15F3N2O2/c1-14(2)9-15(23-3,7-10(8-20)13(14)22)12-11(16(17,18)19)5-4-6-21-12/h4-7H,9H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	24	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578537 (7-methoxy-4- oxo-7-(pyridin- 2- yl)spiro[2.5]oct- ...) Show SMILES COC1(CC2(CC2)C(=O)C(=C1)C#N)c1ccccn1 |c:10| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	179	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578538 (7-methoxy-4- oxo-7-[3- (trifluoromethyl) pyridin-2...) Show SMILES COC1(CC2(CC2)C(=O)C(=C1)C#N)c1ncccc1C(F)(F)F |c:10| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	47	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578539 (7-methoxy-4-7- (4-methyl-1,3- thiazol-2-yl)-4- oxo...) Show SMILES COC1(CC2(CC2)C(=O)C(=C1)C#N)c1nc(C)cs1 |c:10| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	261	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair
hek293 luciferase (Human immunodeficiency virus type 1 group M subtyp...)	BDBM578540 (7-(3,5- difluoropyridin- 2-yl)-7- methoxy-4- oxosp...) Show SMILES COC1(CC2(CC2)C(=O)C(=C1)C#N)c1ncc(F)cc1F |c:10| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	153	n/a	n/a	n/a	n/a
TBA					Assay Description Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GQ720P
					More data for this Ligand-Target Pair

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