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Compile Data Set for Download or QSAR

Found 71 hits from CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279586
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(2-...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc2CN(C)CCc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C25H29N3O4/c1-5-26-25(31)23-22(16-6-7-17-13-28(4)9-8-15(17)10-16)24(32-27-23)19-11-18(14(2)3)20(29)12-21(19)30/h6-7,10-12,14,29-30H,5,8-9,13H2,1-4H3,(H,26,31)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279597
PNG
(3-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(2-...)
Show SMILES CCNC(=O)c1onc(c1-c1ccc2CN(C)CCc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C25H29N3O4/c1-5-26-25(31)24-22(16-6-7-17-13-28(4)9-8-15(17)10-16)23(27-32-24)19-11-18(14(2)3)20(29)12-21(19)30/h6-7,10-12,14,29-30H,5,8-9,13H2,1-4H3,(H,26,31)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279599
PNG
(5-(2,4-dihydroxyl-5-isopropyl-phenyl)-N-ethyl-4-(2...)
Show SMILES CCNC(=O)c1noc(c1C1=CC2CN(C)CC2C1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C23H29N3O4/c1-5-24-23(29)21-20(13-6-14-10-26(4)11-15(14)7-13)22(30-25-21)17-8-16(12(2)3)18(27)9-19(17)28/h6,8-9,12,14-15,27-28H,5,7,10-11H2,1-4H3,(H,24,29)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279603
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-4-(7,7-dimeth...)
Show SMILES CCNC(=O)c1noc(c1-c1cc2CCNC(C)(C)c2s1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C24H29N3O4S/c1-6-25-23(30)20-19(18-9-13-7-8-26-24(4,5)22(13)32-18)21(31-27-20)15-10-14(12(2)3)16(28)11-17(15)29/h9-12,26,28-29H,6-8H2,1-5H3,(H,25,30)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279606
PNG
(N-cyano-5-(2,4-dihydroxyl-5-isopropylphenyl)-4-(2-...)
Show SMILES CC(C)c1cc(-c2onc(C(=N)NC#N)c2-c2ccc3CN(C)CCc3c2)c(O)cc1O
Show InChI InChI=1S/C24H25N5O3/c1-13(2)17-9-18(20(31)10-19(17)30)23-21(22(28-32-23)24(26)27-12-25)15-4-5-16-11-29(3)7-6-14(16)8-15/h4-5,8-10,13,30-31H,6-7,11H2,1-3H3,(H2,26,27)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279607
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(6-...)
Show SMILES CCNC(=O)c1noc(c1-c1cc2CCN(C)CCc2s1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C24H29N3O4S/c1-5-25-24(30)22-21(20-10-14-6-8-27(4)9-7-19(14)32-20)23(31-26-22)16-11-15(13(2)3)17(28)12-18(16)29/h10-13,28-29H,5-9H2,1-4H3,(H,25,30)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279608
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(2-...)
Show SMILES CCNC(=O)c1noc(c1-c1cc2CN(C)CCn2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C23H28N4O4/c1-5-24-23(30)21-20(14-8-15-12-26(4)6-7-27(15)11-14)22(31-25-21)17-9-16(13(2)3)18(28)10-19(17)29/h8-11,13,28-29H,5-7,12H2,1-4H3,(H,24,30)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279610
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(3-...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc2CCN(C)CCc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C26H31N3O4/c1-5-27-26(32)24-23(18-7-6-16-8-10-29(4)11-9-17(16)12-18)25(33-28-24)20-13-19(15(2)3)21(30)14-22(20)31/h6-7,12-15,30-31H,5,8-11H2,1-4H3,(H,27,32)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279611
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(2-...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc2CN(C)CCCc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C26H31N3O4/c1-5-27-26(32)24-23(17-8-9-18-14-29(4)10-6-7-16(18)11-17)25(33-28-24)20-12-19(15(2)3)21(30)13-22(20)31/h8-9,11-13,15,30-31H,5-7,10,14H2,1-4H3,(H,27,32)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279612
PNG
(3-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(3-...)
Show SMILES CCNC(=O)c1onc(c1-c1ccc2CCN(C)CCc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C26H31N3O4/c1-5-27-26(32)25-23(18-7-6-16-8-10-29(4)11-9-17(16)12-18)24(28-33-25)20-13-19(15(2)3)21(30)14-22(20)31/h6-7,12-15,30-31H,5,8-11H2,1-4H3,(H,27,32)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279613
PNG
(3-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(2,...)
Show SMILES CCNC(=O)c1onc(c1-c1ccc2CCNCCc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C25H29N3O4/c1-4-27-25(31)24-22(17-6-5-15-7-9-26-10-8-16(15)11-17)23(28-32-24)19-12-18(14(2)3)20(29)13-21(19)30/h5-6,11-14,26,29-30H,4,7-10H2,1-3H3,(H,27,31)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279614
PNG
(3-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(is...)
Show SMILES CCNC(=O)c1onc(c1-c1ccc2cnccc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C24H23N3O4/c1-4-26-24(30)23-21(15-5-6-16-12-25-8-7-14(16)9-15)22(27-31-23)18-10-17(13(2)3)19(28)11-20(18)29/h5-13,28-29H,4H2,1-3H3,(H,26,30)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279617
PNG
(5-(2,4-dihydroxyl-5-methylphenyl)-N-ethyl-4-(2-met...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc2CN(C)CCc2c1)-c1cc(C)c(O)cc1O
Show InChI InChI=1S/C23H25N3O4/c1-4-24-23(29)21-20(15-5-6-16-12-26(3)8-7-14(16)10-15)22(30-25-21)17-9-13(2)18(27)11-19(17)28/h5-6,9-11,27-28H,4,7-8,12H2,1-3H3,(H,24,29)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279619
PNG
(5-(5-ethyl-2,4-dihydroxyl-phenyl)-N-ethyl-4-(2-met...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc2CN(C)CCc2c1)-c1cc(CC)c(O)cc1O
Show InChI InChI=1S/C24H27N3O4/c1-4-14-11-18(20(29)12-19(14)28)23-21(22(26-31-23)24(30)25-5-2)16-6-7-17-13-27(3)9-8-15(17)10-16/h6-7,10-12,28-29H,4-5,8-9,13H2,1-3H3,(H,25,30)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279620
PNG
(5-(5-cyclopropyl-2,4-dihydroxyl-phenyl)-N-ethyl-4-...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc2CN(C)CCc2c1)-c1cc(C2CC2)c(O)cc1O
Show InChI InChI=1S/C25H27N3O4/c1-3-26-25(31)23-22(16-6-7-17-13-28(2)9-8-15(17)10-16)24(32-27-23)19-11-18(14-4-5-14)20(29)12-21(19)30/h6-7,10-12,14,29-30H,3-5,8-9,13H2,1-2H3,(H,26,31)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279621
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-methyl-4-(2...)
Show SMILES CNC(=O)c1noc(c1-c1ccc2CN(C)CCc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C24H27N3O4/c1-13(2)17-10-18(20(29)11-19(17)28)23-21(22(26-31-23)24(30)25-3)15-5-6-16-12-27(4)8-7-14(16)9-15/h5-6,9-11,13,28-29H,7-8,12H2,1-4H3,(H,25,30)
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CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279625
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-(2-fluoroet...)
Show SMILES CC(C)c1cc(-c2onc(C(=O)NCCF)c2-c2ccc3CN(C)CCc3c2)c(O)cc1O
Show InChI InChI=1S/C25H28FN3O4/c1-14(2)18-11-19(21(31)12-20(18)30)24-22(23(28-33-24)25(32)27-8-7-26)16-4-5-17-13-29(3)9-6-15(17)10-16/h4-5,10-12,14,30-31H,6-9,13H2,1-3H3,(H,27,32)
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CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279626
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-(2-methoxye...)
Show SMILES COCCNC(=O)c1noc(c1-c1ccc2CN(C)CCc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C26H31N3O5/c1-15(2)19-12-20(22(31)13-21(19)30)25-23(24(28-34-25)26(32)27-8-10-33-4)17-5-6-18-14-29(3)9-7-16(18)11-17/h5-6,11-13,15,30-31H,7-10,14H2,1-4H3,(H,27,32)
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CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279629
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(2-...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc2CN(CCO)CCc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C26H31N3O5/c1-4-27-26(33)24-23(17-5-6-18-14-29(9-10-30)8-7-16(18)11-17)25(34-28-24)20-12-19(15(2)3)21(31)13-22(20)32/h5-6,11-13,15,30-32H,4,7-10,14H2,1-3H3,(H,27,33)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279630
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(2-...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc2CN(CCOC)CCc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C27H33N3O5/c1-5-28-27(33)25-24(18-6-7-19-15-30(10-11-34-4)9-8-17(19)12-18)26(35-29-25)21-13-20(16(2)3)22(31)14-23(21)32/h6-7,12-14,16,31-32H,5,8-11,15H2,1-4H3,(H,28,33)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279634
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(2-...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc2CN(CC)CCc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C26H31N3O4/c1-5-27-26(32)24-23(17-7-8-18-14-29(6-2)10-9-16(18)11-17)25(33-28-24)20-12-19(15(3)4)21(30)13-22(20)31/h7-8,11-13,15,30-31H,5-6,9-10,14H2,1-4H3,(H,27,32)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279646
PNG
(3-(2,4-dihydroxyl-5-isopropylphenyl)-4-(2-methyl-1...)
Show SMILES CC(C)c1cc(-c2noc(C(N)=O)c2-c2ccc3CN(C)CCc3c2)c(O)cc1O
Show InChI InChI=1S/C23H25N3O4/c1-12(2)16-9-17(19(28)10-18(16)27)21-20(22(23(24)29)30-25-21)14-4-5-15-11-26(3)7-6-13(15)8-14/h4-5,8-10,12,27-28H,6-7,11H2,1-3H3,(H2,24,29)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279647
PNG
(3-(2,4-dihydroxyl-5-isopropylphenyl)-N-methyl-4-(2...)
Show SMILES CNC(=O)c1onc(c1-c1ccc2CN(C)CCc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C24H27N3O4/c1-13(2)17-10-18(20(29)11-19(17)28)22-21(23(31-26-22)24(30)25-3)15-5-6-16-12-27(4)8-7-14(16)9-15/h5-6,9-11,13,28-29H,7-8,12H2,1-4H3,(H,25,30)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279648
PNG
(3-(2,4-dihydroxyl-5-isopropylphenyl)-N-isopropyl-4...)
Show SMILES CC(C)NC(=O)c1onc(c1-c1ccc2CN(C)CCc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C26H31N3O4/c1-14(2)19-11-20(22(31)12-21(19)30)24-23(25(33-28-24)26(32)27-15(3)4)17-6-7-18-13-29(5)9-8-16(18)10-17/h6-7,10-12,14-15,30-31H,8-9,13H2,1-5H3,(H,27,32)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279649
PNG
(3-(2,4-dihydroxyl-5-isopropylphenyl)-N-(2-hydroxyl...)
Show SMILES CC(C)c1cc(-c2noc(C(=O)NCCO)c2-c2ccc3CN(C)CCc3c2)c(O)cc1O
Show InChI InChI=1S/C25H29N3O5/c1-14(2)18-11-19(21(31)12-20(18)30)23-22(24(33-27-23)25(32)26-7-9-29)16-4-5-17-13-28(3)8-6-15(17)10-16/h4-5,10-12,14,29-31H,6-9,13H2,1-3H3,(H,26,32)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279650
PNG
(3-(2,4-dihydroxyl-5-isopropylphenyl)-N-(2-fluoroet...)
Show SMILES CC(C)c1cc(-c2noc(C(=O)NCCF)c2-c2ccc3CN(C)CCc3c2)c(O)cc1O
Show InChI InChI=1S/C25H28FN3O4/c1-14(2)18-11-19(21(31)12-20(18)30)23-22(24(33-28-23)25(32)27-8-7-26)16-4-5-17-13-29(3)9-6-15(17)10-16/h4-5,10-12,14,30-31H,6-9,13H2,1-3H3,(H,27,32)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279651
PNG
(3-(2,4-dihydroxyl-5-isopropylphenyl)-N-(3-hydroxyl...)
Show SMILES CC(C)c1cc(-c2noc(C(=O)NCCCO)c2-c2ccc3CN(C)CCc3c2)c(O)cc1O
Show InChI InChI=1S/C26H31N3O5/c1-15(2)19-12-20(22(32)13-21(19)31)24-23(25(34-28-24)26(33)27-8-4-10-30)17-5-6-18-14-29(3)9-7-16(18)11-17/h5-6,11-13,15,30-32H,4,7-10,14H2,1-3H3,(H,27,33)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279652
PNG
(3-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(1,...)
Show SMILES CCNC(=O)c1onc(c1-c1ccc2CNCCc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C24H27N3O4/c1-4-26-24(30)23-21(15-5-6-16-12-25-8-7-14(16)9-15)22(27-31-23)18-10-17(13(2)3)19(28)11-20(18)29/h5-6,9-11,13,25,28-29H,4,7-8,12H2,1-3H3,(H,26,30)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279653
PNG
(3-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(2-...)
Show SMILES CCNC(=O)c1onc(c1-c1ccc2CN(CCc2c1)C(C)C)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C27H33N3O4/c1-6-28-27(33)26-24(18-7-8-19-14-30(16(4)5)10-9-17(19)11-18)25(29-34-26)21-12-20(15(2)3)22(31)13-23(21)32/h7-8,11-13,15-16,31-32H,6,9-10,14H2,1-5H3,(H,28,33)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279654
PNG
(3-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(2-...)
Show SMILES CCNC(=O)c1onc(c1-c1ccc2CN(CCO)CCc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C26H31N3O5/c1-4-27-26(33)25-23(17-5-6-18-14-29(9-10-30)8-7-16(18)11-17)24(28-34-25)20-12-19(15(2)3)21(31)13-22(20)32/h5-6,11-13,15,30-32H,4,7-10,14H2,1-3H3,(H,27,33)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279655
PNG
(3-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(2-...)
Show SMILES CCNC(=O)c1onc(c1-c1ccc2CN(CCOC)CCc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C27H33N3O5/c1-5-28-27(33)26-24(18-6-7-19-15-30(10-11-34-4)9-8-17(19)12-18)25(29-35-26)21-13-20(16(2)3)22(31)14-23(21)32/h6-7,12-14,16,31-32H,5,8-11,15H2,1-4H3,(H,28,33)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279656
PNG
(3-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(2-...)
Show SMILES CCNC(=O)c1onc(c1-c1ccc2CN(CCF)CCc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C26H30FN3O4/c1-4-28-26(33)25-23(17-5-6-18-14-30(10-8-27)9-7-16(18)11-17)24(29-34-25)20-12-19(15(2)3)21(31)13-22(20)32/h5-6,11-13,15,31-32H,4,7-10,14H2,1-3H3,(H,28,33)
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n/an/a<20n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279587
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(1-...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc2CCCN(C)c2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C25H29N3O4/c1-5-26-25(31)23-22(16-9-8-15-7-6-10-28(4)19(15)11-16)24(32-27-23)18-12-17(14(2)3)20(29)13-21(18)30/h8-9,11-14,29-30H,5-7,10H2,1-4H3,(H,26,31)
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n/an/a 60n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279645
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(2-...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc2CN(CCc2c1)C(=O)CN1CCOCC1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C30H36N4O6/c1-4-31-30(38)28-27(29(40-32-28)23-14-22(18(2)3)24(35)15-25(23)36)20-5-6-21-16-34(8-7-19(21)13-20)26(37)17-33-9-11-39-12-10-33/h5-6,13-15,18,35-36H,4,7-12,16-17H2,1-3H3,(H,31,38)
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CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279589
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(1,...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc2C3CCC(N3)c2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C25H27N3O4/c1-4-26-25(31)23-22(13-5-6-14-16(9-13)19-8-7-18(14)27-19)24(32-28-23)17-10-15(12(2)3)20(29)11-21(17)30/h5-6,9-12,18-19,27,29-30H,4,7-8H2,1-3H3,(H,26,31)
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CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279590
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(9-...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc2C3CCC(N3C)c2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C26H29N3O4/c1-5-27-26(32)24-23(14-6-7-15-17(10-14)20-9-8-19(15)29(20)4)25(33-28-24)18-11-16(13(2)3)21(30)12-22(18)31/h6-7,10-13,19-20,30-31H,5,8-9H2,1-4H3,(H,27,32)
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CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279591
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(9-...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc2C3CCC(N3CC)c2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C27H31N3O4/c1-5-28-27(33)25-24(15-7-8-16-18(11-15)21-10-9-20(16)30(21)6-2)26(34-29-25)19-12-17(14(3)4)22(31)13-23(19)32/h7-8,11-14,20-21,31-32H,5-6,9-10H2,1-4H3,(H,28,33)
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CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279592
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(9-...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc2C3CCC(N3C(C)C)c2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C28H33N3O4/c1-6-29-28(34)26-25(27(35-30-26)20-12-18(14(2)3)23(32)13-24(20)33)16-7-8-17-19(11-16)22-10-9-21(17)31(22)15(4)5/h7-8,11-15,21-22,32-33H,6,9-10H2,1-5H3,(H,29,34)
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n/an/a 60n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279593
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(9-...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc2C3CCC(N3CC(C)C)c2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C29H35N3O4/c1-6-30-29(35)27-26(28(36-31-27)21-12-19(16(4)5)24(33)13-25(21)34)17-7-8-18-20(11-17)23-10-9-22(18)32(23)14-15(2)3/h7-8,11-13,15-16,22-23,33-34H,6,9-10,14H2,1-5H3,(H,30,35)
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n/an/a 60n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279594
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(5-...)
Show SMILES CCNC(=O)c1noc(c1-c1cc2CN(C)CCc2s1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C23H27N3O4S/c1-5-24-23(29)21-20(19-8-13-11-26(4)7-6-18(13)31-19)22(30-25-21)15-9-14(12(2)3)16(27)10-17(15)28/h8-10,12,27-28H,5-7,11H2,1-4H3,(H,24,29)
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n/an/a 60n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279595
PNG
(5-(2,4-dihydroxyl-5-isopropyl-phenyl)-N-ethyl-4-(5...)
Show SMILES CCNC(=O)c1noc(c1-c1nc2CN(C)CCc2s1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C22H26N4O4S/c1-5-23-21(29)19-18(22-24-14-10-26(4)7-6-17(14)31-22)20(30-25-19)13-8-12(11(2)3)15(27)9-16(13)28/h8-9,11,27-28H,5-7,10H2,1-4H3,(H,23,29)
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n/an/a 60n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279596
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(6-...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc2CN(C)CCc2n1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C24H28N4O4/c1-5-25-24(31)22-21(18-7-6-14-12-28(4)9-8-17(14)26-18)23(32-27-22)16-10-15(13(2)3)19(29)11-20(16)30/h6-7,10-11,13,29-30H,5,8-9,12H2,1-4H3,(H,25,31)
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CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279588
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(1-...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc2N(C)CCCc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C25H29N3O4/c1-5-26-25(31)23-22(16-8-9-19-15(11-16)7-6-10-28(19)4)24(32-27-23)18-12-17(14(2)3)20(29)13-21(18)30/h8-9,11-14,29-30H,5-7,10H2,1-4H3,(H,26,31)
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n/an/a 60n/an/an/an/a7.4n/a



CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279600
PNG
(4-isopropyl-6-[4-(2-methyl-1,2,3,4-tetrahydroisoqu...)
Show SMILES CC(C)c1cc(-c2onc(-c3nnc(C)[nH]3)c2-c2ccc3CN(C)CCc3c2)c(O)cc1O
Show InChI InChI=1S/C25H27N5O3/c1-13(2)18-10-19(21(32)11-20(18)31)24-22(23(29-33-24)25-26-14(3)27-28-25)16-5-6-17-12-30(4)8-7-15(17)9-16/h5-6,9-11,13,31-32H,7-8,12H2,1-4H3,(H,26,27,28)
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CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279601
PNG
(4-(3-(5-ethyl-1H-imidazol-2-yl)-4-(2-methyl-1,2,3,...)
Show SMILES CCc1cnc([nH]1)-c1noc(c1-c1ccc2CN(C)CCc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C27H30N4O3/c1-5-19-13-28-27(29-19)25-24(17-6-7-18-14-31(4)9-8-16(18)10-17)26(34-30-25)21-11-20(15(2)3)22(32)12-23(21)33/h6-7,10-13,15,32-33H,5,8-9,14H2,1-4H3,(H,28,29)
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CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279602
PNG
(4-(3-(5-ethyl-1H-imidazol-2-yl)-4-(2-(2-hydroxyeth...)
Show SMILES CCc1cnc([nH]1)-c1noc(c1-c1ccc2CN(CCO)CCc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C28H32N4O4/c1-4-20-14-29-28(30-20)26-25(18-5-6-19-15-32(9-10-33)8-7-17(19)11-18)27(36-31-26)22-12-21(16(2)3)23(34)13-24(22)35/h5-6,11-14,16,33-35H,4,7-10,15H2,1-3H3,(H,29,30)
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CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279604
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(6-...)
Show SMILES CCNC(=O)c1noc(c1-c1cnc2CCN(C)Cc2c1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C24H28N4O4/c1-5-25-24(31)22-21(14-8-15-12-28(4)7-6-18(15)26-11-14)23(32-27-22)17-9-16(13(2)3)19(29)10-20(17)30/h8-11,13,29-30H,5-7,12H2,1-4H3,(H,25,31)
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CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279605
PNG
(4-isopropyl-6-(4-(2-methyl-1,2,3,4-tetrahydroisoqu...)
Show SMILES CC(C)c1cc(-c2onc(C(O)C(F)(F)F)c2-c2ccc3CN(C)CCc3c2)c(O)cc1O
Show InChI InChI=1S/C24H25F3N2O4/c1-12(2)16-9-17(19(31)10-18(16)30)22-20(21(28-33-22)23(32)24(25,26)27)14-4-5-15-11-29(3)7-6-13(15)8-14/h4-5,8-10,12,23,30-32H,6-7,11H2,1-3H3
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CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279609
PNG
(5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(5-...)
Show SMILES CCNC(=O)c1noc(c1-c1nc2CN(CC(C)C)CCc2n1C)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C26H35N5O4/c1-7-27-26(34)23-22(24(35-29-23)17-10-16(15(4)5)20(32)11-21(17)33)25-28-18-13-31(12-14(2)3)9-8-19(18)30(25)6/h10-11,14-15,32-33H,7-9,12-13H2,1-6H3,(H,27,34)
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CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (human))
BDBM279615
PNG
(5-(2,4-dihydroxyl-5-bromo-phenyl)-N-ethyl-4-(2-met...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc2CN(C)CCc2c1)-c1cc(Br)c(O)cc1O
Show InChI InChI=1S/C22H22BrN3O4/c1-3-24-22(29)20-19(13-4-5-14-11-26(2)7-6-12(14)8-13)21(30-25-20)15-9-16(23)18(28)10-17(15)27/h4-5,8-10,27-28H,3,6-7,11H2,1-2H3,(H,24,29)
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CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD.

US Patent


Assay Description
The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...


US Patent US10035792 (2018)

More data for this
Ligand-Target Pair
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