Compile Data Set for Download or QSAR

Found 8 hits of kd data for polymerid = 9955   

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
3-hydroxyacyl-CoA dehydrogenase type-2 (Homo sapiens (Human))	BDBM232926 (US9346839, 7 | US9738668, Compound 7) Show SMILES CCOP(=O)(OCC)[C@@H](Nc1nc2ccc(OC)cc2s1)c1ccc(O)c(c1)C(=O)OC |r| Show InChI InChI=1S/C21H25N2O7PS/c1-5-29-31(26,30-6-2)19(13-7-10-17(24)15(11-13)20(25)28-4)23-21-22-16-9-8-14(27-3)12-18(16)32-21/h7-12,19,24H,5-6H2,1-4H3,(H,22,23)/t19-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2.80E+3	-31.7	9.90E+3	256	n/a	n/a	n/a	7.3	25
University of Kansas US Patent					Assay Description The assay for the inhibition of reduction of S-acetoacetyl-CoA (SAAC) by ABAD was carried out with ABAD (418 ng/ml), SAAC (172 μM), NADH (102 μ...				US Patent US9346839 (2016) BindingDB Entry DOI: 10.7270/Q2J1022N
					More data for this Ligand-Target Pair
3-hydroxyacyl-CoA dehydrogenase type-2 (Homo sapiens (Human))	BDBM232928 (US9346839, 9 | US9738668, Compound 9) Show SMILES COc1ccc2nc(N[C@@H](c3ccccc3O)P(=O)(OC)OC)sc2c1 |r| Show InChI InChI=1S/C17H19N2O5PS/c1-22-11-8-9-13-15(10-11)26-17(18-13)19-16(25(21,23-2)24-3)12-6-4-5-7-14(12)20/h4-10,16,20H,1-3H3,(H,18,19)/t16-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2.00E+3	-32.5	7.20E+3	264	n/a	n/a	n/a	7.3	25
University of Kansas US Patent					Assay Description The assay for the inhibition of reduction of S-acetoacetyl-CoA (SAAC) by ABAD was carried out with ABAD (418 ng/ml), SAAC (172 μM), NADH (102 μ...				US Patent US9346839 (2016) BindingDB Entry DOI: 10.7270/Q2J1022N
					More data for this Ligand-Target Pair
3-hydroxyacyl-CoA dehydrogenase type-2 (Homo sapiens (Human))	BDBM232931 (US9346839, 15 | US9738668, Compound 15) Show SMILES COc1ccc2nc(N[C@@H](c3ccc(F)cc3)P(=O)(OC)OC)sc2c1 |r| Show InChI InChI=1S/C17H18FN2O4PS/c1-22-13-8-9-14-15(10-13)26-17(19-14)20-16(25(21,23-2)24-3)11-4-6-12(18)7-5-11/h4-10,16H,1-3H3,(H,19,20)/t16-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	3.56E+5	-19.7	1.26E+6	264	n/a	n/a	n/a	7.4	25
University of Kansas US Patent					Assay Description The interactions between compounds and ABAD were performed using the dual flow cell BIACORE 3000 instrument. Surface Plasmon Resonance (SPR) studies ...				US Patent US9346839 (2016) BindingDB Entry DOI: 10.7270/Q2J1022N
					More data for this Ligand-Target Pair
3-hydroxyacyl-CoA dehydrogenase type-2 (Homo sapiens (Human))	BDBM232927 (US9346839, 8 | US9738668, Compound 8) Show SMILES COc1ccc2nc(N[C@@H](c3ccc(O)cc3)P(=O)(OC)OC)sc2c1 |r| Show InChI InChI=1S/C17H19N2O5PS/c1-22-13-8-9-14-15(10-13)26-17(18-14)19-16(25(21,23-2)24-3)11-4-6-12(20)7-5-11/h4-10,16,20H,1-3H3,(H,18,19)/t16-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.49E+4	-27.5	5.27E+4	291	n/a	n/a	n/a	7.4	25
University of Kansas US Patent					Assay Description The interactions between compounds and ABAD were performed using the dual flow cell BIACORE 3000 instrument. Surface Plasmon Resonance (SPR) studies ...				US Patent US9346839 (2016) BindingDB Entry DOI: 10.7270/Q2J1022N
					More data for this Ligand-Target Pair
3-hydroxyacyl-CoA dehydrogenase type-2 (Homo sapiens (Human))	BDBM232930 (US9346839, 11 | US9738668, Compound 11) Show SMILES COc1ccc2nc(N[C@@H](c3ccc[nH]3)P(=O)(OC)OC)sc2c1 |r| Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	9.60E+3	-28.6	3.41E+4	380	n/a	n/a	n/a	7.3	25
University of Kansas US Patent					Assay Description The assay for the inhibition of reduction of S-acetoacetyl-CoA (SAAC) by ABAD was carried out with ABAD (418 ng/ml), SAAC (172 μM), NADH (102 μ...				US Patent US9346839 (2016) BindingDB Entry DOI: 10.7270/Q2J1022N
					More data for this Ligand-Target Pair
3-hydroxyacyl-CoA dehydrogenase type-2 (Homo sapiens (Human))	BDBM232923 (US9346839, 4 | US9738668, Compound 4) Show SMILES COC(=O)c1cc(ccc1O)[C@H](Nc1nc2ccc(OC)cc2s1)P(=O)(OC)OC |r| Show InChI InChI=1S/C19H21N2O7PS/c1-25-12-6-7-14-16(10-12)30-19(20-14)21-17(29(24,27-3)28-4)11-5-8-15(22)13(9-11)18(23)26-2/h5-10,17,22H,1-4H3,(H,20,21)/t17-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	5.50E+3	-30.0	1.96E+4	496	n/a	n/a	n/a	7.3	25
University of Kansas US Patent					Assay Description The assay for the inhibition of reduction of S-acetoacetyl-CoA (SAAC) by ABAD was carried out with ABAD (418 ng/ml), SAAC (172 μM), NADH (102 μ...				US Patent US9346839 (2016) BindingDB Entry DOI: 10.7270/Q2J1022N
					More data for this Ligand-Target Pair
3-hydroxyacyl-CoA dehydrogenase type-2 (Homo sapiens (Human))	BDBM232923 (US9346839, 4 | US9738668, Compound 4) Show SMILES COC(=O)c1cc(ccc1O)[C@H](Nc1nc2ccc(OC)cc2s1)P(=O)(OC)OC |r| Show InChI InChI=1S/C19H21N2O7PS/c1-25-12-6-7-14-16(10-12)30-19(20-14)21-17(29(24,27-3)28-4)11-5-8-15(22)13(9-11)18(23)26-2/h5-10,17,22H,1-4H3,(H,20,21)/t17-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	9.66E+4	-22.9	3.41E+5	496	n/a	n/a	n/a	7.4	25
University of Kansas US Patent					Assay Description The interactions between compounds and ABAD were performed using the dual flow cell BIACORE 3000 instrument. Surface Plasmon Resonance (SPR) studies ...				US Patent US9346839 (2016) BindingDB Entry DOI: 10.7270/Q2J1022N
					More data for this Ligand-Target Pair
3-hydroxyacyl-CoA dehydrogenase type-2 (Homo sapiens (Human))	BDBM232924 (US9346839, 5 | US9738668, Compound 5) Show SMILES COC(=O)c1cc(ccc1O)[C@H](Nc1nc2cc(F)ccc2s1)P(=O)(OC)OC |r| Show InChI InChI=1S/C18H18FN2O6PS/c1-25-17(23)12-8-10(4-6-14(12)22)16(28(24,26-2)27-3)21-18-20-13-9-11(19)5-7-15(13)29-18/h4-9,16,22H,1-3H3,(H,20,21)/t16-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	9.11E+4	-23.1	3.35E+5	954	n/a	n/a	n/a	7.3	25
University of Kansas US Patent					Assay Description The assay for the inhibition of reduction of S-acetoacetyl-CoA (SAAC) by ABAD was carried out with ABAD (418 ng/ml), SAAC (172 μM), NADH (102 μ...				US Patent US9346839 (2016) BindingDB Entry DOI: 10.7270/Q2J1022N
					More data for this Ligand-Target Pair