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Compile Data Set for Download or QSAR

Found 2142 hits Enz. Inhib. hit(s) with Target = 'Plasminogen'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Plasminogen activator inhibitor-1


(Homo sapiens (Human))
BDBM92482
PNG
(CDE-008 | US9120744, CDE-008)
Show SMILES Oc1cc(cc(O)c1O)C(=O)OCCOC(=O)c1cc(O)c(O)c(O)c1
Show InChI InChI=1S/C16H14O10/c17-9-3-7(4-10(18)13(9)21)15(23)25-1-2-26-16(24)8-5-11(19)14(22)12(20)6-8/h3-6,17-22H,1-2H2
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n/an/an/a 23n/an/an/a5.023



THE REGENTS OF THE UNIVERSITY OF MICHIGAN; EASTERN MICHIGAN UNIVERSITY

US Patent


Assay Description
To establish binding constants for the compounds/drugs to PAI-1, an indirect approach using surface plasmon resonance (SPR) was employed. Varying con...


US Patent US9120744 (2015)


BindingDB Entry DOI: 10.7270/Q2QF8RN8
More data for this
Ligand-Target Pair
Plasminogen activator inhibitor-1


(Homo sapiens (Human))
BDBM92487
PNG
(CDE-031 | US9120744, CDE-031)
Show SMILES Oc1cc(cc(O)c1O)C(=O)O[C@@H]1CCCC[C@@H]1OC(=O)c1cc(O)c(O)c(O)c1
Show InChI InChI=1S/C20H20O10/c21-11-5-9(6-12(22)17(11)25)19(27)29-15-3-1-2-4-16(15)30-20(28)10-7-13(23)18(26)14(24)8-10/h5-8,15-16,21-26H,1-4H2/t15-,16+
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n/an/an/a 31n/an/an/a5.023



THE REGENTS OF THE UNIVERSITY OF MICHIGAN; EASTERN MICHIGAN UNIVERSITY

US Patent


Assay Description
To establish binding constants for the compounds/drugs to PAI-1, an indirect approach using surface plasmon resonance (SPR) was employed. Varying con...


US Patent US9120744 (2015)


BindingDB Entry DOI: 10.7270/Q2QF8RN8
More data for this
Ligand-Target Pair
Plasminogen activator inhibitor-1


(Homo sapiens (Human))
BDBM92483
PNG
(CDE-034 | US9120744, CDE-034)
Show SMILES Oc1cc(cc(O)c1O)C(=O)O[C@@H]1CCCC[C@H]1OC(=O)c1cc(O)c(O)c(O)c1
Show InChI InChI=1S/C20H20O10/c21-11-5-9(6-12(22)17(11)25)19(27)29-15-3-1-2-4-16(15)30-20(28)10-7-13(23)18(26)14(24)8-10/h5-8,15-16,21-26H,1-4H2/t15-,16-/m1/s1
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n/an/an/a 67n/an/an/a5.023



THE REGENTS OF THE UNIVERSITY OF MICHIGAN; EASTERN MICHIGAN UNIVERSITY

US Patent


Assay Description
To establish binding constants for the compounds/drugs to PAI-1, an indirect approach using surface plasmon resonance (SPR) was employed. Varying con...


US Patent US9120744 (2015)


BindingDB Entry DOI: 10.7270/Q2QF8RN8
More data for this
Ligand-Target Pair
Plasminogen activator inhibitor-1


(Homo sapiens (Human))
BDBM92484
PNG
(CDE-056 | US9120744, CDE-056)
Show SMILES Oc1cc(cc(O)c1O)C(=O)Oc1ccccc1OC(=O)c1cc(O)c(O)c(O)c1
Show InChI InChI=1S/C20H14O10/c21-11-5-9(6-12(22)17(11)25)19(27)29-15-3-1-2-4-16(15)30-20(28)10-7-13(23)18(26)14(24)8-10/h1-8,21-26H
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n/an/an/a 51n/an/an/a5.023



THE REGENTS OF THE UNIVERSITY OF MICHIGAN; EASTERN MICHIGAN UNIVERSITY

US Patent


Assay Description
To establish binding constants for the compounds/drugs to PAI-1, an indirect approach using surface plasmon resonance (SPR) was employed. Varying con...


US Patent US9120744 (2015)


BindingDB Entry DOI: 10.7270/Q2QF8RN8
More data for this
Ligand-Target Pair
Plasminogen activator inhibitor-1


(Homo sapiens (Human))
BDBM92485
PNG
(CDE-066 | US9120744, CDE-066)
Show SMILES Oc1cc(cc(O)c1O)C(=O)OC[C@H]1OC(OC(=O)c2cc(O)c(O)c(O)c2)[C@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@H]1OC(=O)c1cc(O)c(O)c(O)c1
Show InChI InChI=1S/C41H32O26/c42-17-1-12(2-18(43)28(17)52)36(57)62-11-27-33(64-37(58)13-3-19(44)29(53)20(45)4-13)34(65-38(59)14-5-21(46)30(54)22(47)6-14)35(66-39(60)15-7-23(48)31(55)24(49)8-15)41(63-27)67-40(61)16-9-25(50)32(56)26(51)10-16/h1-10,27,33-35,41-56H,11H2/t27-,33+,34+,35-,41?/m1/s1
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n/an/an/a 3.10n/an/an/a5.023



THE REGENTS OF THE UNIVERSITY OF MICHIGAN; EASTERN MICHIGAN UNIVERSITY

US Patent


Assay Description
To establish binding constants for the compounds/drugs to PAI-1, an indirect approach using surface plasmon resonance (SPR) was employed. Varying con...


US Patent US9120744 (2015)


BindingDB Entry DOI: 10.7270/Q2QF8RN8
More data for this
Ligand-Target Pair
Plasminogen activator inhibitor-1


(Homo sapiens (Human))
BDBM92486
PNG
(CDE-082 | US9120744, CDE-082)
Show SMILES Oc1cc(cc(O)c1O)C(=O)OCC(COC(=O)c1cc(O)c(O)c(O)c1)OC(=O)c1cc(O)c(O)c(O)c1
Show InChI InChI=1S/C24H20O15/c25-13-1-9(2-14(26)19(13)31)22(34)37-7-12(39-24(36)11-5-17(29)21(33)18(30)6-11)8-38-23(35)10-3-15(27)20(32)16(28)4-10/h1-6,12,25-33H,7-8H2
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n/an/an/a 5.30n/an/an/a5.023



THE REGENTS OF THE UNIVERSITY OF MICHIGAN; EASTERN MICHIGAN UNIVERSITY

US Patent


Assay Description
To establish binding constants for the compounds/drugs to PAI-1, an indirect approach using surface plasmon resonance (SPR) was employed. Varying con...


US Patent US9120744 (2015)


BindingDB Entry DOI: 10.7270/Q2QF8RN8
More data for this
Ligand-Target Pair
Plasminogen


(Homo sapiens (human))
BDBM50009926
PNG
(CHEMBL3250026)
Show SMILES NC(=[NH2+])SCc1ccc(CS(=O)(=O)Oc2ccc(cc2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C15H15N3O5S2.BrH/c16-15(17)24-9-11-1-3-12(4-2-11)10-25(21,22)23-14-7-5-13(6-8-14)18(19)20;/h1-8H,9-10H2,(H3,16,17);1H
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1.20E+6n/an/an/an/an/an/a6.0n/a



TBA

Curated by ChEMBL


Assay Description
Competitive inhibition of 4.8 X 10'-7 M human plasmin using Z-Lys-nitrophenyl ester as substrate incubated up to 1 hr at pH 6


J Med Chem 21: 456-9 (1978)


Article DOI: 10.1021/jm00203a009
BindingDB Entry DOI: 10.7270/Q2736SFF
More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290335
PNG
(10-(2,6-Difluorophenyl)-4-(piperidin-4-yl)pyrimido...)
Show SMILES Fc1cccc(F)c1-c1cccc2nn3c(cc(=O)[nH]c3c12)C1CCNCC1
Show InChI InChI=1S/C21H18F2N4O/c22-14-4-2-5-15(23)19(14)13-3-1-6-16-20(13)21-25-18(28)11-17(27(21)26-16)12-7-9-24-10-8-12/h1-6,11-12,24H,7-10H2,(H,25,28)
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n/an/a 15n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290336
PNG
(10-Chloro-8-methyl-4-(piperidin-4-yl)pyrimido[1,2-...)
Show SMILES Cc1cc(Cl)c2c(c1)nn1c(cc(=O)[nH]c21)C1CCNCC1
Show InChI InChI=1S/C16H17ClN4O/c1-9-6-11(17)15-12(7-9)20-21-13(8-14(22)19-16(15)21)10-2-4-18-5-3-10/h6-8,10,18H,2-5H2,1H3,(H,19,22)
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n/an/a 11n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290337
PNG
(4-(Piperidin-4-yl)-10-[2-(trifluoromethoxy)phenyl]...)
Show SMILES FC(F)(F)Oc1ccccc1-c1cccc2nn3c(cc(=O)[nH]c3c12)C1CCNCC1
Show InChI InChI=1S/C22H19F3N4O2/c23-22(24,25)31-18-7-2-1-4-14(18)15-5-3-6-16-20(15)21-27-19(30)12-17(29(21)28-16)13-8-10-26-11-9-13/h1-7,12-13,26H,8-11H2,(H,27,30)
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n/an/a 18n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290338
PNG
(10-Bromo-8-fluoro-4-(piperidin-4-yl)pyrimido[1,2-b...)
Show SMILES Fc1cc(Br)c2c(c1)nn1c(cc(=O)[nH]c21)C1CCNCC1
Show InChI InChI=1S/C15H14BrFN4O/c16-10-5-9(17)6-11-14(10)15-19-13(22)7-12(21(15)20-11)8-1-3-18-4-2-8/h5-8,18H,1-4H2,(H,19,22)
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n/an/a 16n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290339
PNG
(4-(Piperidin-4-yl)-10-(pyridin-2-yl)pyrimido[1,2-b...)
Show SMILES O=c1cc(C2CCNCC2)n2nc3cccc(-c4ccccn4)c3c2[nH]1
Show InChI InChI=1S/C20H19N5O/c26-18-12-17(13-7-10-21-11-8-13)25-20(23-18)19-14(4-3-6-16(19)24-25)15-5-1-2-9-22-15/h1-6,9,12-13,21H,7-8,10-11H2,(H,23,26)
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n/an/a 20n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290340
PNG
(4-(Piperidin-4-yl)-10-(1,3-thiazol-2-yl)pyrimido[1...)
Show SMILES O=c1cc(C2CCNCC2)n2nc3cccc(-c4nccs4)c3c2[nH]1
Show InChI InChI=1S/C18H17N5OS/c24-15-10-14(11-4-6-19-7-5-11)23-17(21-15)16-12(18-20-8-9-25-18)2-1-3-13(16)22-23/h1-3,8-11,19H,4-7H2,(H,21,24)
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n/an/a 41n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290341
PNG
(4-(Piperidin-4-yl)-10-(3-thienyl)pyrimido[1,2-b]in...)
Show SMILES O=c1cc(C2CCNCC2)n2nc3cccc(-c4ccsc4)c3c2[nH]1
Show InChI InChI=1S/C19H18N4OS/c24-17-10-16(12-4-7-20-8-5-12)23-19(21-17)18-14(13-6-9-25-11-13)2-1-3-15(18)22-23/h1-3,6,9-12,20H,4-5,7-8H2,(H,21,24)
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n/an/a 23n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290342
PNG
(10-(2-Methylphenyl)-4-(piperidin-4-yl)pyrimido[1,2...)
Show SMILES Cc1ccccc1-c1cccc2nn3c(cc(=O)[nH]c3c12)C1CCNCC1
Show InChI InChI=1S/C22H22N4O/c1-14-5-2-3-6-16(14)17-7-4-8-18-21(17)22-24-20(27)13-19(26(22)25-18)15-9-11-23-12-10-15/h2-8,13,15,23H,9-12H2,1H3,(H,24,27)
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n/an/a 18n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290343
PNG
(10-(1-Methyl-1H-pyrazol-5-yl)-4-(piperidin-4-yl)py...)
Show SMILES Cn1nccc1-c1cccc2nn3c(cc(=O)[nH]c3c12)C1CCNCC1
Show InChI InChI=1S/C19H20N6O/c1-24-15(7-10-21-24)13-3-2-4-14-18(13)19-22-17(26)11-16(25(19)23-14)12-5-8-20-9-6-12/h2-4,7,10-12,20H,5-6,8-9H2,1H3,(H,22,26)
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n/an/a 15n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290344
PNG
(10-(1-Methyl-1H-pyrazol-4-yl)-4-(piperidin-4-yl)py...)
Show SMILES Cn1cc(cn1)-c1cccc2nn3c(cc(=O)[nH]c3c12)C1CCNCC1
Show InChI InChI=1S/C19H20N6O/c1-24-11-13(10-21-24)14-3-2-4-15-18(14)19-22-17(26)9-16(25(19)23-15)12-5-7-20-8-6-12/h2-4,9-12,20H,5-8H2,1H3,(H,22,26)
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n/an/a 25n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290345
PNG
(4-(Piperidin-4-yl)-10-(2-thienyl)pyrimido[1,2-b]in...)
Show SMILES O=c1cc(C2CCNCC2)n2nc3cccc(-c4cccs4)c3c2[nH]1
Show InChI InChI=1S/C19H18N4OS/c24-17-11-15(12-6-8-20-9-7-12)23-19(21-17)18-13(16-5-2-10-25-16)3-1-4-14(18)22-23/h1-5,10-12,20H,6-9H2,(H,21,24)
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n/an/a 26n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290346
PNG
(10-Bromo-8-methyl-4-(piperidin-4-yl)pyrimido[1,2-b...)
Show SMILES Cc1cc(Br)c2c(c1)nn1c(cc(=O)[nH]c21)C1CCNCC1
Show InChI InChI=1S/C16H17BrN4O/c1-9-6-11(17)15-12(7-9)20-21-13(8-14(22)19-16(15)21)10-2-4-18-5-3-10/h6-8,10,18H,2-5H2,1H3,(H,19,22)
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n/an/a 36n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290347
PNG
(10-Chloro-9-fluoro-4-(piperidin-4-yl)pyrimido[1,2-...)
Show SMILES Fc1ccc2nn3c(cc(=O)[nH]c3c2c1Cl)C1CCNCC1
Show InChI InChI=1S/C15H14ClFN4O/c16-14-9(17)1-2-10-13(14)15-19-12(22)7-11(21(15)20-10)8-3-5-18-6-4-8/h1-2,7-8,18H,3-6H2,(H,19,22)
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n/an/a 24n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290348
PNG
(4-(Piperidin-4-yl)-10-(1H-1,2,4-triazol-1-yl)pyrim...)
Show SMILES O=c1cc(C2CCNCC2)n2nc3cccc(-n4cncn4)c3c2[nH]1
Show InChI InChI=1S/C17H17N7O/c25-15-8-14(11-4-6-18-7-5-11)24-17(21-15)16-12(22-24)2-1-3-13(16)23-10-19-9-20-23/h1-3,8-11,18H,4-7H2,(H,21,25)
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n/an/a 27n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290349
PNG
(9-Fluoro-10-(2-fluorophenyl)-4-(piperidin-4-yl)pyr...)
Show SMILES Fc1ccccc1-c1c(F)ccc2nn3c(cc(=O)[nH]c3c12)C1CCNCC1
Show InChI InChI=1S/C21H18F2N4O/c22-14-4-2-1-3-13(14)19-15(23)5-6-16-20(19)21-25-18(28)11-17(27(21)26-16)12-7-9-24-10-8-12/h1-6,11-12,24H,7-10H2,(H,25,28)
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n/an/a 27n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290350
PNG
(10-(2-Ethoxyphenyl)-4-(piperidin-4-yl)pyrimido[1,2...)
Show SMILES CCOc1ccccc1-c1cccc2nn3c(cc(=O)[nH]c3c12)C1CCNCC1
Show InChI InChI=1S/C23H24N4O2/c1-2-29-20-9-4-3-6-16(20)17-7-5-8-18-22(17)23-25-21(28)14-19(27(23)26-18)15-10-12-24-13-11-15/h3-9,14-15,24H,2,10-13H2,1H3,(H,25,28)
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n/an/a 28n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290351
PNG
(10-(2-Isopropoxyphenyl)-4-(piperidin-4-yl)pyrimido...)
Show SMILES CC(C)Oc1ccccc1-c1cccc2nn3c(cc(=O)[nH]c3c12)C1CCNCC1
Show InChI InChI=1S/C24H26N4O2/c1-15(2)30-21-9-4-3-6-17(21)18-7-5-8-19-23(18)24-26-22(29)14-20(28(24)27-19)16-10-12-25-13-11-16/h3-9,14-16,25H,10-13H2,1-2H3,(H,26,29)
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n/an/a 35n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290314
PNG
(10-(2-Fluorophenyl)-4-(piperidin-4-yl)pyrimido[1,2...)
Show SMILES Fc1ccccc1-c1cccc2nn3c(cc(=O)[nH]c3c12)C1CCNCC1
Show InChI InChI=1S/C21H19FN4O/c22-16-6-2-1-4-14(16)15-5-3-7-17-20(15)21-24-19(27)12-18(26(21)25-17)13-8-10-23-11-9-13/h1-7,12-13,23H,8-11H2,(H,24,27)
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n/an/a 18n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290353
PNG
(4-(Piperidin-4-yl)-10-(1H-pyrazol-1-yl)pyrimido[1,...)
Show SMILES O=c1cc(C2CCNCC2)n2nc3cccc(-n4cccn4)c3c2[nH]1
Show InChI InChI=1S/C18H18N6O/c25-16-11-15(12-5-8-19-9-6-12)24-18(21-16)17-13(22-24)3-1-4-14(17)23-10-2-7-20-23/h1-4,7,10-12,19H,5-6,8-9H2,(H,21,25)
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n/an/a 26n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290354
PNG
(10-(2-Fluoro-6-methoxyphenyl)-4-(piperidin-4-yl)py...)
Show SMILES COc1cccc(F)c1-c1cccc2nn3c(cc(=O)[nH]c3c12)C1CCNCC1
Show InChI InChI=1S/C22H21FN4O2/c1-29-18-7-3-5-15(23)20(18)14-4-2-6-16-21(14)22-25-19(28)12-17(27(22)26-16)13-8-10-24-11-9-13/h2-7,12-13,24H,8-11H2,1H3,(H,25,28)
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n/an/a 30n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290355
PNG
(4-(Piperidin-4-yl)-10-(2H-1,2,3-triazol-2-yl)pyrim...)
Show SMILES O=c1cc(C2CCNCC2)n2nc3cccc(-n4nccn4)c3c2[nH]1
Show InChI InChI=1S/C17H17N7O/c25-15-10-14(11-4-6-18-7-5-11)23-17(21-15)16-12(22-23)2-1-3-13(16)24-19-8-9-20-24/h1-3,8-11,18H,4-7H2,(H,21,25)
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n/an/a 27n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290356
PNG
(4-(Piperidin-4-yl)-10-(1H-1,2,3-triazol-1-yl)pyrim...)
Show SMILES O=c1cc(C2CCNCC2)n2nc3cccc(-n4ccnn4)c3c2[nH]1
Show InChI InChI=1S/C17H17N7O/c25-15-10-14(11-4-6-18-7-5-11)24-17(20-15)16-12(21-24)2-1-3-13(16)23-9-8-19-22-23/h1-3,8-11,18H,4-7H2,(H,20,25)
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n/an/a 29n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290357
PNG
(10-Chloro-7-methyl-4-(piperidin-4-yl)pyrimido[1,2-...)
Show SMILES Cc1ccc(Cl)c2c1nn1c(cc(=O)[nH]c21)C1CCNCC1
Show InChI InChI=1S/C16H17ClN4O/c1-9-2-3-11(17)14-15(9)20-21-12(8-13(22)19-16(14)21)10-4-6-18-7-5-10/h2-3,8,10,18H,4-7H2,1H3,(H,19,22)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290358
PNG
((+)-Cis-10-Chloro-4-(2-methylpiperidin-4-yl)pyrimi...)
Show SMILES CC1CC(CCN1)c1cc(=O)[nH]c2c3c(Cl)cccc3nn12
Show InChI InChI=1S/C16H17ClN4O/c1-9-7-10(5-6-18-9)13-8-14(22)19-16-15-11(17)3-2-4-12(15)20-21(13)16/h2-4,8-10,18H,5-7H2,1H3,(H,19,22)
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n/an/a 35n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290359
PNG
(10-(1H-imidazol-5-yl)-4-(piperidin-4-yl)pyrimido[1...)
Show SMILES O=c1cc(C2CCNCC2)n2nc3cccc(-c4cnc[nH]4)c3c2[nH]1
Show InChI InChI=1S/C18H18N6O/c25-16-8-15(11-4-6-19-7-5-11)24-18(22-16)17-12(14-9-20-10-21-14)2-1-3-13(17)23-24/h1-3,8-11,19H,4-7H2,(H,20,21)(H,22,25)
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n/an/a 110n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290360
PNG
(4-(piperidin-4-yl)-10-(1H-pyrrol-2-yl)pyrimido[1,2...)
Show SMILES O=c1cc(C2CCNCC2)n2nc3cccc(-c4ccc[nH]4)c3c2[nH]1
Show InChI InChI=1S/C19H19N5O/c25-17-11-16(12-6-9-20-10-7-12)24-19(22-17)18-13(14-5-2-8-21-14)3-1-4-15(18)23-24/h1-5,8,11-12,20-21H,6-7,9-10H2,(H,22,25)
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n/an/a 35n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290361
PNG
(10-hydroxy-4-(piperidin-4-yl)pyrimido[1,2-b]indazo...)
Show SMILES Oc1cccc2nn3c(cc(=O)[nH]c3c12)C1CCNCC1
Show InChI InChI=1S/C15H16N4O2/c20-12-3-1-2-10-14(12)15-17-13(21)8-11(19(15)18-10)9-4-6-16-7-5-9/h1-3,8-9,16,20H,4-7H2,(H,17,21)
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n/an/a 74n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290362
PNG
(2-oxo-4-(piperidin-4-yl)-1,2-dihydropyrimido[1,2-b...)
Show SMILES OC(=O)c1cccc2nn3c(cc(=O)[nH]c3c12)C1CCNCC1
Show InChI InChI=1S/C16H16N4O3/c21-13-8-12(9-4-6-17-7-5-9)20-15(18-13)14-10(16(22)23)2-1-3-11(14)19-20/h1-3,8-9,17H,4-7H2,(H,18,21)(H,22,23)
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n/an/a 420n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290363
PNG
(4-(piperidin-4-yl)-10-(2,2,2-trifluoroethoxy)pyrim...)
Show SMILES FC(F)(F)COc1cccc2nn3c(cc(=O)[nH]c3c12)C1CCNCC1
Show InChI InChI=1S/C17H17F3N4O2/c18-17(19,20)9-26-13-3-1-2-11-15(13)16-22-14(25)8-12(24(16)23-11)10-4-6-21-7-5-10/h1-3,8,10,21H,4-7,9H2,(H,22,25)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290364
PNG
(10-amino-4-(piperidin-4-yl)pyrimido[1,2-b]indazol-...)
Show SMILES Nc1cccc2nn3c(cc(=O)[nH]c3c12)C1CCNCC1
Show InChI InChI=1S/C15H17N5O/c16-10-2-1-3-11-14(10)15-18-13(21)8-12(20(15)19-11)9-4-6-17-7-5-9/h1-3,8-9,17H,4-7,16H2,(H,18,21)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290271
PNG
(4-(Piperidin-4-yl)-10-(trifluoromethyl)pyrimido[1,...)
Show SMILES FC(F)(F)c1cccc2nn3c(cc(=O)[nH]c3c12)C1CCNCC1
Show InChI InChI=1S/C16H15F3N4O/c17-16(18,19)10-2-1-3-11-14(10)15-21-13(24)8-12(23(15)22-11)9-4-6-20-7-5-9/h1-3,8-9,20H,4-7H2,(H,21,24)
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n/an/a 32n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290272
PNG
(8-tert-Butyl-4-(piperidin-4-yl)pyrido[2′,3&#...)
Show SMILES CC(C)(C)c1ccc2c(nn3c(cc(=O)[nH]c23)C2CCNCC2)n1
Show InChI InChI=1S/C18H23N5O/c1-18(2,3)14-5-4-12-16(20-14)22-23-13(10-15(24)21-17(12)23)11-6-8-19-9-7-11/h4-5,10-11,19H,6-9H2,1-3H3,(H,21,24)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290273
PNG
(10-Methyl-4-(piperidin-4-yl)-8-(trifluoromethyl)py...)
Show SMILES Cc1cc(cc2nn3c(cc(=O)[nH]c3c12)C1CCNCC1)C(F)(F)F
Show InChI InChI=1S/C17H17F3N4O/c1-9-6-11(17(18,19)20)7-12-15(9)16-22-14(25)8-13(24(16)23-12)10-2-4-21-5-3-10/h6-8,10,21H,2-5H2,1H3,(H,22,25)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290274
PNG
(9-Methyl-4-(piperidin-4-yl)pyrimido[1,2-b]indazol-...)
Show SMILES Cc1ccc2nn3c(cc(=O)[nH]c3c2c1)C1CCNCC1
Show InChI InChI=1S/C16H18N4O/c1-10-2-3-13-12(8-10)16-18-15(21)9-14(20(16)19-13)11-4-6-17-7-5-11/h2-3,8-9,11,17H,4-7H2,1H3,(H,18,21)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290275
PNG
(8-Amino-4-(piperidin-4-yl)pyrimido[1,2-b]indazol-2...)
Show SMILES Nc1ccc2c(c1)nn1c(cc(=O)[nH]c21)C1CCNCC1
Show InChI InChI=1S/C15H17N5O/c16-10-1-2-11-12(7-10)19-20-13(8-14(21)18-15(11)20)9-3-5-17-6-4-9/h1-2,7-9,17H,3-6,16H2,(H,18,21)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290276
PNG
(3,4-Dimethyl-8-(piperidin-4-yl)pyrimido[1′,2...)
Show SMILES Cc1nnc2nn3c(cc(=O)[nH]c3c2c1C)C1CCNCC1
Show InChI InChI=1S/C15H18N6O/c1-8-9(2)18-19-14-13(8)15-17-12(22)7-11(21(15)20-14)10-3-5-16-6-4-10/h7,10,16H,3-6H2,1-2H3,(H,17,22)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290277
PNG
(8-Fluoro-4-(piperidin-4-yl)pyrimido[1,2-b]indazol-...)
Show SMILES Fc1ccc2c(c1)nn1c(cc(=O)[nH]c21)C1CCNCC1
Show InChI InChI=1S/C15H15FN4O/c16-10-1-2-11-12(7-10)19-20-13(8-14(21)18-15(11)20)9-3-5-17-6-4-9/h1-2,7-9,17H,3-6H2,(H,18,21)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290278
PNG
(9-Bromo-4-(piperidin-4-yl)pyrimido[1,2-b]indazol-2...)
Show SMILES Brc1ccc2nn3c(cc(=O)[nH]c3c2c1)C1CCNCC1
Show InChI InChI=1S/C15H15BrN4O/c16-10-1-2-12-11(7-10)15-18-14(21)8-13(20(15)19-12)9-3-5-17-6-4-9/h1-2,7-9,17H,3-6H2,(H,18,21)
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n/an/a 26n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290279
PNG
(10-Iodo-4-(piperidin-4-yl)pyrimido[1,2-b]indazol-2...)
Show SMILES Ic1cccc2nn3c(cc(=O)[nH]c3c12)C1CCNCC1
Show InChI InChI=1S/C15H15IN4O/c16-10-2-1-3-11-14(10)15-18-13(21)8-12(20(15)19-11)9-4-6-17-7-5-9/h1-3,8-9,17H,4-7H2,(H,18,21)
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UniChem
US Patent
n/an/a 22n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290280
PNG
(8-Bromo-4-(piperidin-4-yl)pyrimido[1,2-b]indazol-2...)
Show SMILES Brc1ccc2c(c1)nn1c(cc(=O)[nH]c21)C1CCNCC1
Show InChI InChI=1S/C15H15BrN4O/c16-10-1-2-11-12(7-10)19-20-13(8-14(21)18-15(11)20)9-3-5-17-6-4-9/h1-2,7-9,17H,3-6H2,(H,18,21)
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US Patent
n/an/a 30n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290281
PNG
(7-Chloro-4-(piperidin-4-yl)pyrimido[1,2-b]indazol-...)
Show SMILES Clc1cccc2c1nn1c(cc(=O)[nH]c21)C1CCNCC1
Show InChI InChI=1S/C15H15ClN4O/c16-11-3-1-2-10-14(11)19-20-12(8-13(21)18-15(10)20)9-4-6-17-7-5-9/h1-3,8-9,17H,4-7H2,(H,18,21)
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UniChem
US Patent
n/an/a 26n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290282
PNG
(8,10-Difluoro-4-(piperidin-4-yl)pyrimido[1,2-b]ind...)
Show SMILES Fc1cc(F)c2c(c1)nn1c(cc(=O)[nH]c21)C1CCNCC1
Show InChI InChI=1S/C15H14F2N4O/c16-9-5-10(17)14-11(6-9)20-21-12(7-13(22)19-15(14)21)8-1-3-18-4-2-8/h5-8,18H,1-4H2,(H,19,22)
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UniChem
US Patent
n/an/a 28n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
Plasminogen (aa101-181)


(Homo sapiens (human))
BDBM290283
PNG
(8-Methyl-4-(piperidin-4-yl)pyrido[2′,3′...)
Show SMILES Cc1ccc2c(nn3c(cc(=O)[nH]c23)C2CCNCC2)n1
Show InChI InChI=1S/C15H17N5O/c1-9-2-3-11-14(17-9)19-20-12(8-13(21)18-15(11)20)10-4-6-16-7-5-10/h2-3,8,10,16H,4-7H2,1H3,(H,18,21)
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US Patent
n/an/a 34n/an/an/an/a7.0n/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The test compounds were dissolved in 1% acetic acid and further complemented with an equal volume of DMSO. The resulting stock solutions were seriall...


US Patent US10098883 (2018)

More data for this
Ligand-Target Pair
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