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Compile Data Set for Download or QSAR

Found 417 hits with Last Name = 'hammer' and Initial = 'k'   
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
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443054
PNG
(2-((3-(benzyloxy)phenyl)amino)-N- hydroxy-1-methyl...)
Show SMILES Cn1c(Nc2cccc(OCc3ccccc3)c2)nc2cc(ccc12)C(=O)NO
Show InChI InChI=1S/C22H20N4O3/c1-26-20-11-10-16(21(27)25-28)12-19(20)24-22(26)23-17-8-5-9-18(13-17)29-14-15-6-3-2-4-7-15/h2-13,28H,14H2,1H3,(H,23,24)(H,25,27)
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n/an/a 1n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM425866
PNG
(2-(5-chloro-2- hydroxyphenyl)-N-hydroxy- 1H-benzim...)
Show SMILES ONC(=O)c1ccc2nc([nH]c2c1)-c1cc(Cl)ccc1O
Show InChI InChI=1S/C14H10ClN3O3/c15-8-2-4-12(19)9(6-8)13-16-10-3-1-7(14(20)18-21)5-11(10)17-13/h1-6,19,21H,(H,16,17)(H,18,20)
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n/an/a 2n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
All Examples were tested in HDAC1, 2, 3, 6 and 8 in vitro enzymatic assays. The assay principle is well known (Hauser et al. 2009, Bradner et al. 201...


US Patent US10512634 (2019)


BindingDB Entry DOI: 10.7270/Q2WD42ZQ
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM425877
PNG
(2-[5-(2-fluorophenyl) thiophen-2-yl]- N-hydroxy-1H...)
Show SMILES ONC(=O)c1ccc2nc([nH]c2c1)-c1ccc(s1)-c1ccccc1F
Show InChI InChI=1S/C18H12FN3O2S/c19-12-4-2-1-3-11(12)15-7-8-16(25-15)17-20-13-6-5-10(18(23)22-24)9-14(13)21-17/h1-9,24H,(H,20,21)(H,22,23)
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n/an/a 2.90n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
All Examples were tested in HDAC1, 2, 3, 6 and 8 in vitro enzymatic assays. The assay principle is well known (Hauser et al. 2009, Bradner et al. 201...


US Patent US10512634 (2019)


BindingDB Entry DOI: 10.7270/Q2WD42ZQ
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443101
PNG
(N-hydroxy-2-[4-(6-methoxypyridin- 3-yl)phenyl]-1,3...)
Show SMILES COc1ccc(cn1)-c1ccc(cc1)-c1nc2cc(ccc2o1)C(=O)NO
Show InChI InChI=1S/C20H15N3O4/c1-26-18-9-7-15(11-21-18)12-2-4-13(5-3-12)20-22-16-10-14(19(24)23-25)6-8-17(16)27-20/h2-11,25H,1H3,(H,23,24)
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n/an/a 3n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443012
PNG
(N-hydroxy-2-[4-(1- methylethyl)phenyl]-1,3- benzot...)
Show SMILES CC(C)c1ccc(cc1)-c1nc2cc(ccc2s1)C(=O)NO
Show InChI InChI=1S/C17H16N2O2S/c1-10(2)11-3-5-12(6-4-11)17-18-14-9-13(16(20)19-21)7-8-15(14)22-17/h3-10,21H,1-2H3,(H,19,20)
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KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM425879
PNG
(N-hydroxy-2-(5- phenylthiophen-2-yl)-1H- benzimida...)
Show SMILES ONC(=O)c1ccc2nc([nH]c2c1)-c1ccc(s1)-c1ccccc1
Show InChI InChI=1S/C18H13N3O2S/c22-18(21-23)12-6-7-13-14(10-12)20-17(19-13)16-9-8-15(24-16)11-4-2-1-3-5-11/h1-10,23H,(H,19,20)(H,21,22)
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n/an/a 3.10n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
All Examples were tested in HDAC1, 2, 3, 6 and 8 in vitro enzymatic assays. The assay principle is well known (Hauser et al. 2009, Bradner et al. 201...


US Patent US10512634 (2019)


BindingDB Entry DOI: 10.7270/Q2WD42ZQ
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM425892
PNG
(N-hydroxy-2-(4-methoxy- 3,5-dimethylphenyl)-1- met...)
Show SMILES COc1c(C)cc(cc1C)-c1nc2cc(ccc2n1C)C(=O)NO
Show InChI InChI=1S/C18H19N3O3/c1-10-7-13(8-11(2)16(10)24-4)17-19-14-9-12(18(22)20-23)5-6-15(14)21(17)3/h5-9,23H,1-4H3,(H,20,22)
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n/an/a 3.5n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
All Examples were tested in HDAC1, 2, 3, 6 and 8 in vitro enzymatic assays. The assay principle is well known (Hauser et al. 2009, Bradner et al. 201...


US Patent US10512634 (2019)


BindingDB Entry DOI: 10.7270/Q2WD42ZQ
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM425892
PNG
(N-hydroxy-2-(4-methoxy- 3,5-dimethylphenyl)-1- met...)
Show SMILES COc1c(C)cc(cc1C)-c1nc2cc(ccc2n1C)C(=O)NO
Show InChI InChI=1S/C18H19N3O3/c1-10-7-13(8-11(2)16(10)24-4)17-19-14-9-12(18(22)20-23)5-6-15(14)21(17)3/h5-9,23H,1-4H3,(H,20,22)
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n/an/a 3.5n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
All Examples were tested in HDAC1, 2, 3, 6 and 8 in vitro enzymatic assays. The assay principle is well known (Hauser et al. 2009, Bradner et al. 201...


US Patent US10512634 (2019)


BindingDB Entry DOI: 10.7270/Q2WD42ZQ
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM425891
PNG
(2-biphenyl-4-yl-N-hydroxy- 1-methyl-1H-benzimidazo...)
Show SMILES Cn1c(nc2cc(ccc12)C(=O)NO)-c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C21H17N3O2/c1-24-19-12-11-17(21(25)23-26)13-18(19)22-20(24)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-13,26H,1H3,(H,23,25)
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n/an/a 3.60n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
All Examples were tested in HDAC1, 2, 3, 6 and 8 in vitro enzymatic assays. The assay principle is well known (Hauser et al. 2009, Bradner et al. 201...


US Patent US10512634 (2019)


BindingDB Entry DOI: 10.7270/Q2WD42ZQ
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM425886
PNG
(N-hydroxy-2-[4'-(pyrrolidin- 1-ylmethyl)biphenyl-4...)
Show SMILES ONC(=O)c1ccc2nc([nH]c2c1)-c1ccc(cc1)-c1ccc(CN2CCCC2)cc1
Show InChI InChI=1S/C25H24N4O2/c30-25(28-31)21-11-12-22-23(15-21)27-24(26-22)20-9-7-19(8-10-20)18-5-3-17(4-6-18)16-29-13-1-2-14-29/h3-12,15,31H,1-2,13-14,16H2,(H,26,27)(H,28,30)
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n/an/a 3.60n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
All Examples were tested in HDAC1, 2, 3, 6 and 8 in vitro enzymatic assays. The assay principle is well known (Hauser et al. 2009, Bradner et al. 201...


US Patent US10512634 (2019)


BindingDB Entry DOI: 10.7270/Q2WD42ZQ
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM425891
PNG
(2-biphenyl-4-yl-N-hydroxy- 1-methyl-1H-benzimidazo...)
Show SMILES Cn1c(nc2cc(ccc12)C(=O)NO)-c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C21H17N3O2/c1-24-19-12-11-17(21(25)23-26)13-18(19)22-20(24)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-13,26H,1H3,(H,23,25)
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n/an/a 3.60n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
All Examples were tested in HDAC1, 2, 3, 6 and 8 in vitro enzymatic assays. The assay principle is well known (Hauser et al. 2009, Bradner et al. 201...


US Patent US10512634 (2019)


BindingDB Entry DOI: 10.7270/Q2WD42ZQ
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443098
PNG
(N-hydroxy-2-(3-methoxyphenyl)-1- benzofuran-6-carb...)
Show SMILES COc1cccc(c1)-c1cc2ccc(cc2o1)C(=O)NO
Show InChI InChI=1S/C16H13NO4/c1-20-13-4-2-3-10(7-13)14-8-11-5-6-12(16(18)17-19)9-15(11)21-14/h2-9,19H,1H3,(H,17,18)
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n/an/a 4n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443081
PNG
(2-[(biphenyl-4-ylmethyl)amino]-N- hydroxy-1,3-benz...)
Show SMILES ONC(=O)c1ccc2oc(NCc3ccc(cc3)-c3ccccc3)nc2c1
Show InChI InChI=1S/C21H17N3O3/c25-20(24-26)17-10-11-19-18(12-17)23-21(27-19)22-13-14-6-8-16(9-7-14)15-4-2-1-3-5-15/h1-12,26H,13H2,(H,22,23)(H,24,25)
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n/an/a 4n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443087
PNG
(2-[(benzyloxy)methyl]-N-hydroxy- 1,3-benzothiazole...)
Show SMILES ONC(=O)c1ccc2sc(COCc3ccccc3)nc2c1
Show InChI InChI=1S/C16H14N2O3S/c19-16(18-20)12-6-7-14-13(8-12)17-15(22-14)10-21-9-11-4-2-1-3-5-11/h1-8,20H,9-10H2,(H,18,19)
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KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443097
PNG
(N-hydroxy-2-(3-hydroxypheny)-1- benzofuran-6-carbo...)
Show SMILES ONC(=O)c1ccc2cc(oc2c1)-c1cccc(O)c1
Show InChI InChI=1S/C15H11NO4/c17-12-3-1-2-9(6-12)13-7-10-4-5-11(15(18)16-19)8-14(10)20-13/h1-8,17,19H,(H,16,18)
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KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM442978
PNG
(2-(4-bromophenyl)-N-hydroxy-1,3- benzoxazole-5-car...)
Show SMILES ONC(=O)c1ccc2oc(nc2c1)-c1ccc(Br)cc1
Show InChI InChI=1S/C14H9BrN2O3/c15-10-4-1-8(2-5-10)14-16-11-7-9(13(18)17-19)3-6-12(11)20-14/h1-7,19H,(H,17,18)
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KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443098
PNG
(N-hydroxy-2-(3-methoxyphenyl)-1- benzofuran-6-carb...)
Show SMILES COc1cccc(c1)-c1cc2ccc(cc2o1)C(=O)NO
Show InChI InChI=1S/C16H13NO4/c1-20-13-4-2-3-10(7-13)14-8-11-5-6-12(16(18)17-19)9-15(11)21-14/h2-9,19H,1H3,(H,17,18)
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KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM425881
PNG
(N-hydroxy-2-[3'-(piperidin-1- ylmethyl)biphenyl-4-...)
Show SMILES ONC(=O)c1ccc2nc([nH]c2c1)-c1ccc(cc1)-c1cccc(CN2CCCCC2)c1
Show InChI InChI=1S/C26H26N4O2/c31-26(29-32)22-11-12-23-24(16-22)28-25(27-23)20-9-7-19(8-10-20)21-6-4-5-18(15-21)17-30-13-2-1-3-14-30/h4-12,15-16,32H,1-3,13-14,17H2,(H,27,28)(H,29,31)
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n/an/a 4.10n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
All Examples were tested in HDAC1, 2, 3, 6 and 8 in vitro enzymatic assays. The assay principle is well known (Hauser et al. 2009, Bradner et al. 201...


US Patent US10512634 (2019)


BindingDB Entry DOI: 10.7270/Q2WD42ZQ
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM425876
PNG
(2-[5-(3,4- dimethoxyphenyl)furan-2- yl]-N-hydroxy-...)
Show SMILES COc1ccc(cc1OC)-c1ccc(o1)-c1nc2ccc(cc2[nH]1)C(=O)NO
Show InChI InChI=1S/C20H17N3O5/c1-26-16-6-4-11(10-18(16)27-2)15-7-8-17(28-15)19-21-13-5-3-12(20(24)23-25)9-14(13)22-19/h3-10,25H,1-2H3,(H,21,22)(H,23,24)
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n/an/a 4.70n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
All Examples were tested in HDAC1, 2, 3, 6 and 8 in vitro enzymatic assays. The assay principle is well known (Hauser et al. 2009, Bradner et al. 201...


US Patent US10512634 (2019)


BindingDB Entry DOI: 10.7270/Q2WD42ZQ
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM442979
PNG
(2-(4-tert-butylphenyl)-N-hydroxy- 1,3-benzoxazole-...)
Show SMILES CC(C)(C)c1ccc(cc1)-c1nc2cc(ccc2o1)C(=O)NO
Show InChI InChI=1S/C18H18N2O3/c1-18(2,3)13-7-4-11(5-8-13)17-19-14-10-12(16(21)20-22)6-9-15(14)23-17/h4-10,22H,1-3H3,(H,20,21)
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n/an/a 5n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM442984
PNG
(2-(2-chlorophenyl)-N-hydroxy-1,3- benzoxazole-5-ca...)
Show SMILES ONC(=O)c1ccc2oc(nc2c1)-c1ccccc1Cl
Show InChI InChI=1S/C14H9ClN2O3/c15-10-4-2-1-3-9(10)14-16-11-7-8(13(18)17-19)5-6-12(11)20-14/h1-7,19H,(H,17,18)
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n/an/a 5n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM442979
PNG
(2-(4-tert-butylphenyl)-N-hydroxy- 1,3-benzoxazole-...)
Show SMILES CC(C)(C)c1ccc(cc1)-c1nc2cc(ccc2o1)C(=O)NO
Show InChI InChI=1S/C18H18N2O3/c1-18(2,3)13-7-4-11(5-8-13)17-19-14-10-12(16(21)20-22)6-9-15(14)23-17/h4-10,22H,1-3H3,(H,20,21)
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n/an/a 5n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM442984
PNG
(2-(2-chlorophenyl)-N-hydroxy-1,3- benzoxazole-5-ca...)
Show SMILES ONC(=O)c1ccc2oc(nc2c1)-c1ccccc1Cl
Show InChI InChI=1S/C14H9ClN2O3/c15-10-4-2-1-3-9(10)14-16-11-7-8(13(18)17-19)5-6-12(11)20-14/h1-7,19H,(H,17,18)
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n/an/a 5n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM442990
PNG
(N-hydroxy-2-[4-(4-methoxypyridin- 3-yl)phenyl]-1,3...)
Show SMILES COc1ccncc1-c1ccc(cc1)-c1nc2cc(ccc2o1)C(=O)NO
Show InChI InChI=1S/C20H15N3O4/c1-26-17-8-9-21-11-15(17)12-2-4-13(5-3-12)20-22-16-10-14(19(24)23-25)6-7-18(16)27-20/h2-11,25H,1H3,(H,23,24)
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n/an/a 5n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM425878
PNG
(2-[5-(3- chlorophenyl)thiophen-2- yl]-N-hydroxy-1H...)
Show SMILES ONC(=O)c1ccc2nc([nH]c2c1)-c1ccc(s1)-c1cccc(Cl)c1
Show InChI InChI=1S/C18H12ClN3O2S/c19-12-3-1-2-10(8-12)15-6-7-16(25-15)17-20-13-5-4-11(18(23)22-24)9-14(13)21-17/h1-9,24H,(H,20,21)(H,22,23)
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n/an/a 5.10n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
All Examples were tested in HDAC1, 2, 3, 6 and 8 in vitro enzymatic assays. The assay principle is well known (Hauser et al. 2009, Bradner et al. 201...


US Patent US10512634 (2019)


BindingDB Entry DOI: 10.7270/Q2WD42ZQ
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM425863
PNG
(2-(2,3-dihydro-1-benzofuran- 5-yl)-N-hydroxy-1H- b...)
Show SMILES ONC(=O)c1ccc2nc([nH]c2c1)-c1ccc2OCCc2c1
Show InChI InChI=1S/C16H13N3O3/c20-16(19-21)11-1-3-12-13(8-11)18-15(17-12)10-2-4-14-9(7-10)5-6-22-14/h1-4,7-8,21H,5-6H2,(H,17,18)(H,19,20)
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n/an/a 5.20n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
All Examples were tested in HDAC1, 2, 3, 6 and 8 in vitro enzymatic assays. The assay principle is well known (Hauser et al. 2009, Bradner et al. 201...


US Patent US10512634 (2019)


BindingDB Entry DOI: 10.7270/Q2WD42ZQ
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM425863
PNG
(2-(2,3-dihydro-1-benzofuran- 5-yl)-N-hydroxy-1H- b...)
Show SMILES ONC(=O)c1ccc2nc([nH]c2c1)-c1ccc2OCCc2c1
Show InChI InChI=1S/C16H13N3O3/c20-16(19-21)11-1-3-12-13(8-11)18-15(17-12)10-2-4-14-9(7-10)5-6-22-14/h1-4,7-8,21H,5-6H2,(H,17,18)(H,19,20)
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KANCERA AB

US Patent


Assay Description
All Examples were tested in HDAC1, 2, 3, 6 and 8 in vitro enzymatic assays. The assay principle is well known (Hauser et al. 2009, Bradner et al. 201...


US Patent US10512634 (2019)


BindingDB Entry DOI: 10.7270/Q2WD42ZQ
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443089
PNG
(N-hydroxy-2-(4-pyridin-4- ylbenzyl)-1,3-benzothiaz...)
Show SMILES ONC(=O)c1ccc2sc(Cc3ccc(cc3)-c3ccncc3)nc2c1
Show InChI InChI=1S/C20H15N3O2S/c24-20(23-25)16-5-6-18-17(12-16)22-19(26-18)11-13-1-3-14(4-2-13)15-7-9-21-10-8-15/h1-10,12,25H,11H2,(H,23,24)
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n/an/a 6n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM425869
PNG
(N-hydroxy-2-[3-(4- methoxyphenoxy)phenyl]-1H- benz...)
Show SMILES COc1ccc(Oc2cccc(c2)-c2nc3ccc(cc3[nH]2)C(=O)NO)cc1
Show InChI InChI=1S/C21H17N3O4/c1-27-15-6-8-16(9-7-15)28-17-4-2-3-13(11-17)20-22-18-10-5-14(21(25)24-26)12-19(18)23-20/h2-12,26H,1H3,(H,22,23)(H,24,25)
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KANCERA AB

US Patent


Assay Description
All Examples were tested in HDAC1, 2, 3, 6 and 8 in vitro enzymatic assays. The assay principle is well known (Hauser et al. 2009, Bradner et al. 201...


US Patent US10512634 (2019)


BindingDB Entry DOI: 10.7270/Q2WD42ZQ
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443055
PNG
(2-(4-benzylpiperidin-1-yl)-N- hydroxy-1-methyl-1H-...)
Show SMILES Cn1c(nc2cc(ccc12)C(=O)NO)N1CCC(Cc2ccccc2)CC1
Show InChI InChI=1S/C21H24N4O2/c1-24-19-8-7-17(20(26)23-27)14-18(19)22-21(24)25-11-9-16(10-12-25)13-15-5-3-2-4-6-15/h2-8,14,16,27H,9-13H2,1H3,(H,23,26)
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n/an/a 7n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443056
PNG
(2-([1,1'-biphenyl]-3-ylamino)-N- hydroxy-1-methyl-...)
Show SMILES Cn1c(Nc2cccc(c2)-c2ccccc2)nc2cc(ccc12)C(=O)NO
Show InChI InChI=1S/C21H18N4O2/c1-25-19-11-10-16(20(26)24-27)13-18(19)23-21(25)22-17-9-5-8-15(12-17)14-6-3-2-4-7-14/h2-13,27H,1H3,(H,22,23)(H,24,26)
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n/an/a 7n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443064
PNG
(2-[3-fluorophenoxy)methyl]-N- hydroxy-1-benzofuran...)
Show SMILES ONC(=O)c1ccc2oc(COc3cccc(F)c3)cc2c1
Show InChI InChI=1S/C16H12FNO4/c17-12-2-1-3-13(8-12)21-9-14-7-11-6-10(16(19)18-20)4-5-15(11)22-14/h1-8,20H,9H2,(H,18,19)
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n/an/a 7n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443064
PNG
(2-[3-fluorophenoxy)methyl]-N- hydroxy-1-benzofuran...)
Show SMILES ONC(=O)c1ccc2oc(COc3cccc(F)c3)cc2c1
Show InChI InChI=1S/C16H12FNO4/c17-12-2-1-3-13(8-12)21-9-14-7-11-6-10(16(19)18-20)4-5-15(11)22-14/h1-8,20H,9H2,(H,18,19)
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n/an/a 7n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443016
PNG
(2-(4-fluorobenzyl)-N-hydroxy-1,3- benzothiazole-5-...)
Show SMILES ONC(=O)c1ccc2sc(Cc3ccc(F)cc3)nc2c1
Show InChI InChI=1S/C15H11FN2O2S/c16-11-4-1-9(2-5-11)7-14-17-12-8-10(15(19)18-20)3-6-13(12)21-14/h1-6,8,20H,7H2,(H,18,19)
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n/an/a 7n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443039
PNG
(N-hydroxy-2-[4-(1- methylethyl)phenyl]-1-benzofura...)
Show SMILES CC(C)c1ccc(cc1)-c1cc2ccc(cc2o1)C(=O)NO
Show InChI InChI=1S/C18H17NO3/c1-11(2)12-3-5-13(6-4-12)16-9-14-7-8-15(18(20)19-21)10-17(14)22-16/h3-11,21H,1-2H3,(H,19,20)
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n/an/a 7n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443044
PNG
(2-(([1,1'-biphenyl]-4- ylmethyl)amino)-N-hydroxy-1...)
Show SMILES ONC(=O)c1ccc2nc(NCc3ccc(cc3)-c3ccccc3)[nH]c2c1
Show InChI InChI=1S/C21H18N4O2/c26-20(25-27)17-10-11-18-19(12-17)24-21(23-18)22-13-14-6-8-16(9-7-14)15-4-2-1-3-5-15/h1-12,27H,13H2,(H,25,26)(H2,22,23,24)
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n/an/a 7n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443079
PNG
(2-(biphenyl-3-ylamino)-N-hydroxy- 1,3-benzoxazole-...)
Show SMILES ONC(=O)c1ccc2oc(Nc3cccc(c3)-c3ccccc3)nc2c1
Show InChI InChI=1S/C20H15N3O3/c24-19(23-25)15-9-10-18-17(12-15)22-20(26-18)21-16-8-4-7-14(11-16)13-5-2-1-3-6-13/h1-12,25H,(H,21,22)(H,23,24)
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KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443096
PNG
(2-{4- [(dimethylamino)methyl]phenyl}-N- hydroxy-1-...)
Show SMILES CN(C)Cc1ccc(cc1)-c1cc2ccc(cc2o1)C(=O)NO
Show InChI InChI=1S/C18H18N2O3/c1-20(2)11-12-3-5-13(6-4-12)16-9-14-7-8-15(18(21)19-22)10-17(14)23-16/h3-10,22H,11H2,1-2H3,(H,19,21)
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KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM442986
PNG
(2-(3-bromophenyl)-N-hydroxy-1,3- benzoxazole-5-car...)
Show SMILES ONC(=O)c1ccc2oc(nc2c1)-c1cccc(Br)c1
Show InChI InChI=1S/C14H9BrN2O3/c15-10-3-1-2-9(6-10)14-16-11-7-8(13(18)17-19)4-5-12(11)20-14/h1-7,19H,(H,17,18)
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n/an/a 7n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM425865
PNG
(N-hydroxy-2-thiophen-2-yl- 1H-benzimidazole-6- car...)
Show SMILES ONC(=O)c1ccc2nc([nH]c2c1)-c1cccs1
Show InChI InChI=1S/C12H9N3O2S/c16-12(15-17)7-3-4-8-9(6-7)14-11(13-8)10-2-1-5-18-10/h1-6,17H,(H,13,14)(H,15,16)
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KANCERA AB

US Patent


Assay Description
All Examples were tested in HDAC1, 2, 3, 6 and 8 in vitro enzymatic assays. The assay principle is well known (Hauser et al. 2009, Bradner et al. 201...


US Patent US10512634 (2019)


BindingDB Entry DOI: 10.7270/Q2WD42ZQ
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM425865
PNG
(N-hydroxy-2-thiophen-2-yl- 1H-benzimidazole-6- car...)
Show SMILES ONC(=O)c1ccc2nc([nH]c2c1)-c1cccs1
Show InChI InChI=1S/C12H9N3O2S/c16-12(15-17)7-3-4-8-9(6-7)14-11(13-8)10-2-1-5-18-10/h1-6,17H,(H,13,14)(H,15,16)
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KANCERA AB

US Patent


Assay Description
All Examples were tested in HDAC1, 2, 3, 6 and 8 in vitro enzymatic assays. The assay principle is well known (Hauser et al. 2009, Bradner et al. 201...


US Patent US10512634 (2019)


BindingDB Entry DOI: 10.7270/Q2WD42ZQ
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM425889
PNG
(N-hydroxy-2-{4-[(4- methylpiperazin-1- yl)methyl]p...)
Show SMILES CN1CCN(Cc2ccc(cc2)-c2nc3ccc(cc3[nH]2)C(=O)NO)CC1
Show InChI InChI=1S/C20H23N5O2/c1-24-8-10-25(11-9-24)13-14-2-4-15(5-3-14)19-21-17-7-6-16(20(26)23-27)12-18(17)22-19/h2-7,12,27H,8-11,13H2,1H3,(H,21,22)(H,23,26)
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n/an/a 7n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
All Examples were tested in HDAC1, 2, 3, 6 and 8 in vitro enzymatic assays. The assay principle is well known (Hauser et al. 2009, Bradner et al. 201...


US Patent US10512634 (2019)


BindingDB Entry DOI: 10.7270/Q2WD42ZQ
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM425889
PNG
(N-hydroxy-2-{4-[(4- methylpiperazin-1- yl)methyl]p...)
Show SMILES CN1CCN(Cc2ccc(cc2)-c2nc3ccc(cc3[nH]2)C(=O)NO)CC1
Show InChI InChI=1S/C20H23N5O2/c1-24-8-10-25(11-9-24)13-14-2-4-15(5-3-14)19-21-17-7-6-16(20(26)23-27)12-18(17)22-19/h2-7,12,27H,8-11,13H2,1H3,(H,21,22)(H,23,26)
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n/an/a 7n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
All Examples were tested in HDAC1, 2, 3, 6 and 8 in vitro enzymatic assays. The assay principle is well known (Hauser et al. 2009, Bradner et al. 201...


US Patent US10512634 (2019)


BindingDB Entry DOI: 10.7270/Q2WD42ZQ
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM425888
PNG
(N-hydroxy-2-{4'- [(methylsulfonyl)amino] biphenyl-...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)-c1ccc(cc1)-c1nc2ccc(cc2[nH]1)C(=O)NO
Show InChI InChI=1S/C21H18N4O4S/c1-30(28,29)25-17-9-6-14(7-10-17)13-2-4-15(5-3-13)20-22-18-11-8-16(21(26)24-27)12-19(18)23-20/h2-12,25,27H,1H3,(H,22,23)(H,24,26)
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n/an/a 7.20n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
All Examples were tested in HDAC1, 2, 3, 6 and 8 in vitro enzymatic assays. The assay principle is well known (Hauser et al. 2009, Bradner et al. 201...


US Patent US10512634 (2019)


BindingDB Entry DOI: 10.7270/Q2WD42ZQ
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443068
PNG
(N-hydroxy-2-[4'- (methylsulfonyl)biphenyl-4-yl]-1,...)
Show SMILES CS(=O)(=O)c1ccc(cc1)-c1ccc(cc1)-c1nc2cc(ccc2o1)C(=O)NO
Show InChI InChI=1S/C21H16N2O5S/c1-29(26,27)17-9-6-14(7-10-17)13-2-4-15(5-3-13)21-22-18-12-16(20(24)23-25)8-11-19(18)28-21/h2-12,25H,1H3,(H,23,24)
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n/an/a 8n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM442983
PNG
(N-hydroxy-2-(4-methoxyphenyl)- 1,3-benzoxazole-5-c...)
Show SMILES COc1ccc(cc1)-c1nc2cc(ccc2o1)C(=O)NO
Show InChI InChI=1S/C15H12N2O4/c1-20-11-5-2-9(3-6-11)15-16-12-8-10(14(18)17-19)4-7-13(12)21-15/h2-8,19H,1H3,(H,17,18)
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KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443092
PNG
(N-hydroxy-2-({[4-(1- methylethyl)phenyl]amino}meth...)
Show SMILES CC(C)c1ccc(NCc2nc3cc(ccc3s2)C(=O)NO)cc1
Show InChI InChI=1S/C18H19N3O2S/c1-11(2)12-3-6-14(7-4-12)19-10-17-20-15-9-13(18(22)21-23)5-8-16(15)24-17/h3-9,11,19,23H,10H2,1-2H3,(H,21,22)
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n/an/a 8n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443004
PNG
(N-hydroxy-2-[4-(1- methylethyl)phenyl]-1,3- benzox...)
Show SMILES CC(C)c1ccc(cc1)-c1nc2ccc(cc2o1)C(=O)NO
Show InChI InChI=1S/C17H16N2O3/c1-10(2)11-3-5-12(6-4-11)17-18-14-8-7-13(16(20)19-21)9-15(14)22-17/h3-10,21H,1-2H3,(H,19,20)
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n/an/a 9n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443026
PNG
(N-hydroxy-2-(4-methoxyphenyl)-1- benzothiophene-5-...)
Show SMILES COc1ccc(cc1)-c1cc2cc(ccc2s1)C(=O)NO
Show InChI InChI=1S/C16H13NO3S/c1-20-13-5-2-10(3-6-13)15-9-12-8-11(16(18)17-19)4-7-14(12)21-15/h2-9,19H,1H3,(H,17,18)
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n/an/a 9n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM443095
PNG
(N-hydroxy-2-phenyl-1-benzofuran- 6-carboxamide | U...)
Show SMILES ONC(=O)c1ccc2cc(oc2c1)-c1ccccc1
Show InChI InChI=1S/C15H11NO3/c17-15(16-18)12-7-6-11-8-13(19-14(11)9-12)10-4-2-1-3-5-10/h1-9,18H,(H,16,17)
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n/an/a 9n/an/an/an/an/an/a



KANCERA AB

US Patent


Assay Description
The assay principle is well known and all necessary reagents like enzymes, substrates, developer and reference compounds are commercially available. ...


US Patent US10654814 (2020)


BindingDB Entry DOI: 10.7270/Q2PK0K5Z
More data for this
Ligand-Target Pair
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