BindingDB logo
myBDB logout

Patent code US11066396

Compile Data Set for Download or QSAR

Found 1453 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Histone deacetylase 5


(Homo sapiens (Human))
BDBM504572
PNG
((S)-5-(Benzo[d]oxazol-2-yl)-4-(4-(5-(trifluorometh...)
Show SMILES FC(F)(F)c1nc(no1)-c1ccc(cc1)N1[C@@H](COCC1=O)c1nc2ccccc2o1
Show InChI InChI=1S/C20H13F3N4O4/c21-20(22,23)19-25-17(26-31-19)11-5-7-12(8-6-11)27-14(9-29-10-16(27)28)18-24-13-3-1-2-4-15(13)30-18/h1-8,14H,9-10H2/t14-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 2n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC5 reagents: N-terminal GST tagged HDAC5 was purchased from BPS Bioscience [catalog #50045]. Assays were performed with buffer containing 20 mM HE...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504755
PNG
(2-(((5-(5-(Trifluoromethyl)-1,2,4-oxadiazol-3-yl)p...)
Show SMILES NC(=O)c1ccccc1NCc1ccc(cn1)-c1noc(n1)C(F)(F)F
Show InChI InChI=1S/C16H12F3N5O2/c17-16(18,19)15-23-14(24-26-15)9-5-6-10(21-7-9)8-22-12-4-2-1-3-11(12)13(20)25/h1-7,22H,8H2,(H2,20,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 2.10n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504971
PNG
(N-({5-[5- (trifluoro- methyl)- 1,2,4-oxa- diazol-3...)
Show SMILES FC(F)(F)c1nc(no1)-c1ccc(CNc2ccc3ccncc3c2)nc1
Show InChI InChI=1S/C18H12F3N5O/c19-18(20,21)17-25-16(26-27-17)12-2-4-15(23-9-12)10-24-14-3-1-11-5-6-22-8-13(11)7-14/h1-9,24H,10H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 3n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Histone deacetylase 5


(Homo sapiens (Human))
BDBM504735
PNG
((R)-4-(2,5- difluoro-4-(5- (trifluoromethyl)- 1,2,...)
Show SMILES Fc1cc(-c2noc(n2)C(F)(F)F)c(F)cc1N1[C@@H](COCC1=O)c1ccccc1
Show InChI InChI=1S/C19H12F5N3O3/c20-12-7-14(13(21)6-11(12)17-25-18(30-26-17)19(22,23)24)27-15(8-29-9-16(27)28)10-4-2-1-3-5-10/h1-7,15H,8-9H2/t15-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 3n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC5 reagents: N-terminal GST tagged HDAC5 was purchased from BPS Bioscience [catalog #50045]. Assays were performed with buffer containing 20 mM HE...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM505072
PNG
(1-({5-[5- (trifluoro- methyl)- 1,2,4-oxa- diazol-3...)
Show SMILES FC(F)(F)c1nc(no1)-c1ccc(Cn2c3ccccc3[nH]c(=O)c2=O)nc1
Show InChI InChI=1S/C17H10F3N5O3/c18-17(19,20)16-23-13(24-28-16)9-5-6-10(21-7-9)8-25-12-4-2-1-3-11(12)22-14(26)15(25)27/h1-7H,8H2,(H,22,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 3.40n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM505023
PNG
(4-(methoxy- methyl)- 1-({5-[5- (trifluoro- methyl)...)
Show SMILES COCc1cc(=O)n(Cc2ccc(cn2)-c2noc(n2)C(F)(F)F)c2ccccc12
Show InChI InChI=1S/C20H15F3N4O3/c1-29-11-13-8-17(28)27(16-5-3-2-4-15(13)16)10-14-7-6-12(9-24-14)18-25-19(30-26-18)20(21,22)23/h2-9H,10-11H2,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 3.80n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504529
PNG
((S)-1-(2,5-Difluoro-4-(5-(trifluoromethyl)-1,2,4-o...)
Show SMILES Cc1noc(n1)[C@@H]1CCC(=O)N1c1cc(F)c(cc1F)-c1noc(n1)C(F)(F)F
Show InChI InChI=1S/C16H10F5N5O3/c1-6-22-14(28-24-6)10-2-3-12(27)26(10)11-5-8(17)7(4-9(11)18)13-23-15(29-25-13)16(19,20)21/h4-5,10H,2-3H2,1H3/t10-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 3.90n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504913
PNG
(6-fluoro- 1-({5-[5- (trifluoro- methyl)- 1,2,4-oxa...)
Show SMILES Fc1ccc2N(Cc3ccc(cn3)-c3noc(n3)C(F)(F)F)C(=O)CCc2c1
Show InChI InChI=1S/C18H12F4N4O2/c19-12-3-5-14-10(7-12)2-6-15(27)26(14)9-13-4-1-11(8-23-13)16-24-17(28-25-16)18(20,21)22/h1,3-5,7-8H,2,6,9H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 3.90n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504678
PNG
((S)-5-(1H- benzo[d]imidazol- 2-yl)-1-(2-fluoro- 4-...)
Show SMILES Fc1cc(ccc1N1[C@@H](CCC1=O)c1nc2ccccc2[nH]1)-c1noc(n1)C(F)(F)F
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 4.10n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM505052
PNG
(3-[({5-[5- (trifluoro- methyl)- 1,2,4-oxa- diazol-...)
Show SMILES NC(=O)c1cccc(NCc2ccc(cn2)-c2noc(n2)C(F)(F)F)c1
Show InChI InChI=1S/C16H12F3N5O2/c17-16(18,19)15-23-14(24-26-15)10-4-5-12(21-7-10)8-22-11-3-1-2-9(6-11)13(20)25/h1-7,22H,8H2,(H2,20,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 4.20n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504919
PNG
(7-fluoro- 1-({5-[5- (trifluoro- methyl)- 1,2,4-oxa...)
Show SMILES Fc1ccc2CCC(=O)N(Cc3ccc(cn3)-c3noc(n3)C(F)(F)F)c2c1
Show InChI InChI=1S/C18H12F4N4O2/c19-12-4-1-10-3-6-15(27)26(14(10)7-12)9-13-5-2-11(8-23-13)16-24-17(28-25-16)18(20,21)22/h1-2,4-5,7-8H,3,6,9H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 4.20n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM505048
PNG
(3-[({5-[5- (trifluoro- methyl)- 1,2,4-oxa- diazol-...)
Show SMILES NC(=O)c1ncccc1NCc1ccc(cn1)-c1noc(n1)C(F)(F)F
Show InChI InChI=1S/C15H11F3N6O2/c16-15(17,18)14-23-13(24-26-14)8-3-4-9(21-6-8)7-22-10-2-1-5-20-11(10)12(19)25/h1-6,22H,7H2,(H2,19,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 4.40n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM505063
PNG
(1-({5-[5- (trifluoro- methyl)- 1,2,4-oxa- diazol-3...)
Show SMILES FC(F)(F)c1nc(no1)-c1ccc(Cn2c3ccccc3ccc2=O)nc1
Show InChI InChI=1S/C18H11F3N4O2/c19-18(20,21)17-23-16(24-27-17)12-5-7-13(22-9-12)10-25-14-4-2-1-3-11(14)6-8-15(25)26/h1-9H,10H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 4.5n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504550
PNG
((S)-5-(Benzo[d]oxazol-2-yl)-1-(2-fluoro-4-(5-(trif...)
Show SMILES Fc1cc(ccc1N1[C@@H](CCC1=O)c1nc2ccccc2o1)-c1noc(n1)C(F)(F)F
Show InChI InChI=1S/C20H12F4N4O3/c21-11-9-10(17-26-19(31-27-17)20(22,23)24)5-6-13(11)28-14(7-8-16(28)29)18-25-12-3-1-2-4-15(12)30-18/h1-6,9,14H,7-8H2/t14-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 4.70n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM505049
PNG
(N-cyclo- propyl-2- [({5-[5- (trifluoro- methyl)- 1...)
Show SMILES FC(F)(F)c1nc(no1)-c1ccc(CNc2ccccc2C(=O)NC2CC2)nc1
Show InChI InChI=1S/C19H16F3N5O2/c20-19(21,22)18-26-16(27-29-18)11-5-6-13(23-9-11)10-24-15-4-2-1-3-14(15)17(28)25-12-7-8-12/h1-6,9,12,24H,7-8,10H2,(H,25,28)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 4.70n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504958
PNG
(3-(1,3- oxazol- 5-yl)- N-({5-[5- (trifluoro- methy...)
Show SMILES FC(F)(F)c1nc(no1)-c1ccc(CNc2cccc(c2)-c2cnco2)nc1
Show InChI InChI=1S/C18H12F3N5O2/c19-18(20,21)17-25-16(26-28-17)12-4-5-14(23-7-12)8-24-13-3-1-2-11(6-13)15-9-22-10-27-15/h1-7,9-10,24H,8H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 4.80n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504543
PNG
((S)-5-(3-(Pyridin-2-yl)-1,2,4-oxadiazol-5-yl)-1-(4...)
Show SMILES FC(F)(F)c1nc(no1)-c1ccc(cc1)N1[C@@H](CCC1=O)c1nc(no1)-c1ccccn1
Show InChI InChI=1S/C20H13F3N6O3/c21-20(22,23)19-26-16(27-32-19)11-4-6-12(7-5-11)29-14(8-9-15(29)30)18-25-17(28-31-18)13-3-1-2-10-24-13/h1-7,10,14H,8-9H2/t14-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 5n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Histone deacetylase 5


(Homo sapiens (Human))
BDBM504543
PNG
((S)-5-(3-(Pyridin-2-yl)-1,2,4-oxadiazol-5-yl)-1-(4...)
Show SMILES FC(F)(F)c1nc(no1)-c1ccc(cc1)N1[C@@H](CCC1=O)c1nc(no1)-c1ccccn1
Show InChI InChI=1S/C20H13F3N6O3/c21-20(22,23)19-26-16(27-32-19)11-4-6-12(7-5-11)29-14(8-9-15(29)30)18-25-17(28-31-18)13-3-1-2-10-24-13/h1-7,10,14H,8-9H2/t14-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 5n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC5 reagents: N-terminal GST tagged HDAC5 was purchased from BPS Bioscience [catalog #50045]. Assays were performed with buffer containing 20 mM HE...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504691
PNG
(1-(2-fluoro-4-(5- (trifluoromethyl)- 1,2,4-oxadiaz...)
Show SMILES Fc1ccccc1C1CCC(=O)N1c1ccc(cc1F)-c1noc(n1)C(F)(F)F
Show InChI InChI=1S/C19H12F5N3O2/c20-12-4-2-1-3-11(12)14-7-8-16(28)27(14)15-6-5-10(9-13(15)21)17-25-18(29-26-17)19(22,23)24/h1-6,9,14H,7-8H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 5.10n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504691
PNG
(1-(2-fluoro-4-(5- (trifluoromethyl)- 1,2,4-oxadiaz...)
Show SMILES Fc1ccccc1C1CCC(=O)N1c1ccc(cc1F)-c1noc(n1)C(F)(F)F
Show InChI InChI=1S/C19H12F5N3O2/c20-12-4-2-1-3-11(12)14-7-8-16(28)27(14)15-6-5-10(9-13(15)21)17-25-18(29-26-17)19(22,23)24/h1-6,9,14H,7-8H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 5.10n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM505065
PNG
(4-({5-[5- (trifluoro- methyl)- 1,2,4-oxa- diazol-3...)
Show SMILES FC(F)(F)c1nc(no1)-c1ccc(CN2C(=O)COc3ccccc23)nc1
Show InChI InChI=1S/C17H11F3N4O3/c18-17(19,20)16-22-15(23-27-16)10-5-6-11(21-7-10)8-24-12-3-1-2-4-13(12)26-9-14(24)25/h1-7H,8-9H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 5.10n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504515
PNG
((R)-4-(3-Fluoro-4-(5-(trifluoromethyl)-1,2,4-oxadi...)
Show SMILES Fc1cc(ccc1-c1noc(n1)C(F)(F)F)N1[C@@H](COCC1=O)c1ccccc1
Show InChI InChI=1S/C19H13F4N3O3/c20-14-8-12(6-7-13(14)17-24-18(29-25-17)19(21,22)23)26-15(9-28-10-16(26)27)11-4-2-1-3-5-11/h1-8,15H,9-10H2/t15-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 5.30n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM505047
PNG
(N-methyl- 2-[({5-[5- (trifluoro- methyl)- 1,2,4-ox...)
Show SMILES CNC(=O)c1ccccc1NCc1ccc(cn1)-c1noc(n1)C(F)(F)F
Show InChI InChI=1S/C17H14F3N5O2/c1-21-15(26)12-4-2-3-5-13(12)23-9-11-7-6-10(8-22-11)14-24-16(27-25-14)17(18,19)20/h2-8,23H,9H2,1H3,(H,21,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 5.30n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504542
PNG
((R)-3-(2,5-Difluoro-4-(5-(trifluoromethyl)-1,2,4-o...)
Show SMILES Fc1cc(-c2noc(n2)C(F)(F)F)c(F)cc1N1[C@@H](COC1=O)c1ccccc1
Show InChI InChI=1S/C18H10F5N3O3/c19-11-7-13(26-14(8-28-17(26)27)9-4-2-1-3-5-9)12(20)6-10(11)15-24-16(29-25-15)18(21,22)23/h1-7,14H,8H2/t14-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 5.60n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM505003
PNG
(N-(3-fluoro- phenyl)-2- methyl-N- ({5-[5- (trifluo...)
Show SMILES Cc1ncc(cn1)C(=O)N(Cc1ccc(cn1)-c1noc(n1)C(F)(F)F)c1cccc(F)c1
Show InChI InChI=1S/C21H14F4N6O2/c1-12-26-9-14(10-27-12)19(32)31(17-4-2-3-15(22)7-17)11-16-6-5-13(8-28-16)18-29-20(33-30-18)21(23,24)25/h2-10H,11H2,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 5.80n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504572
PNG
((S)-5-(Benzo[d]oxazol-2-yl)-4-(4-(5-(trifluorometh...)
Show SMILES FC(F)(F)c1nc(no1)-c1ccc(cc1)N1[C@@H](COCC1=O)c1nc2ccccc2o1
Show InChI InChI=1S/C20H13F3N4O4/c21-20(22,23)19-25-17(26-31-19)11-5-7-12(8-6-11)27-14(9-29-10-16(27)28)18-24-13-3-1-2-4-15(13)30-18/h1-8,14H,9-10H2/t14-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 6n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504571
PNG
((S)-5-(3-(Pyridin-2-yl)-1,2,4-oxadiazol-5-yl)-4-(4...)
Show SMILES FC(F)(F)c1nc(no1)-c1ccc(cc1)N1[C@@H](COCC1=O)c1nc(no1)-c1ccccn1
Show InChI InChI=1S/C20H13F3N6O4/c21-20(22,23)19-26-16(27-33-19)11-4-6-12(7-5-11)29-14(9-31-10-15(29)30)18-25-17(28-32-18)13-3-1-2-8-24-13/h1-8,14H,9-10H2/t14-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 6n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504582
PNG
(1-(2,5-difluoro-4- (5-(trifluoromethyl)- 1,2,4-oxa...)
Show SMILES Fc1cc(-c2noc(n2)C(F)(F)F)c(F)cc1N1C(CCC1=O)c1ccccc1
Show InChI InChI=1S/C19H12F5N3O2/c20-12-9-15(27-14(6-7-16(27)28)10-4-2-1-3-5-10)13(21)8-11(12)17-25-18(29-26-17)19(22,23)24/h1-5,8-9,14H,6-7H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 6.10n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504889
PNG
(4-({5-[5- (trifluoro- methyl)- 1,2,4-oxa- diazol-3...)
Show SMILES FC(F)(F)c1nc(no1)-c1ccc(COc2cccc3[nH]nnc23)nc1
Show InChI InChI=1S/C15H9F3N6O2/c16-15(17,18)14-20-13(23-26-14)8-4-5-9(19-6-8)7-25-11-3-1-2-10-12(11)22-24-21-10/h1-6H,7H2,(H,21,22,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 6.10n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504696
PNG
((S)-5-(3-methyl- 1,2,4-oxadiazol-5- yl)-1-(4-(5- (...)
Show SMILES Cc1noc(n1)[C@@H]1CCC(=O)N1c1ccc(cc1)-c1noc(n1)C(F)(F)F
Show InChI InChI=1S/C16H12F3N5O3/c1-8-20-14(26-22-8)11-6-7-12(25)24(11)10-4-2-9(3-5-10)13-21-15(27-23-13)16(17,18)19/h2-5,11H,6-7H2,1H3/t11-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 6.5n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504965
PNG
(3-(1H- 1,2,4- triazol-1-yl)- N-({5-[5- (trifluoro-...)
Show SMILES FC(F)(F)c1nc(no1)-c1ccc(CNc2cccc(c2)-n2cncn2)nc1
Show InChI InChI=1S/C17H12F3N7O/c18-17(19,20)16-25-15(26-28-16)11-4-5-13(22-7-11)8-23-12-2-1-3-14(6-12)27-10-21-9-24-27/h1-7,9-10,23H,8H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 6.60n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Histone deacetylase 5


(Homo sapiens (Human))
BDBM504529
PNG
((S)-1-(2,5-Difluoro-4-(5-(trifluoromethyl)-1,2,4-o...)
Show SMILES Cc1noc(n1)[C@@H]1CCC(=O)N1c1cc(F)c(cc1F)-c1noc(n1)C(F)(F)F
Show InChI InChI=1S/C16H10F5N5O3/c1-6-22-14(28-24-6)10-2-3-12(27)26(10)11-5-8(17)7(4-9(11)18)13-23-15(29-25-13)16(19,20)21/h4-5,10H,2-3H2,1H3/t10-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 7n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC5 reagents: N-terminal GST tagged HDAC5 was purchased from BPS Bioscience [catalog #50045]. Assays were performed with buffer containing 20 mM HE...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Histone deacetylase 5


(Homo sapiens (Human))
BDBM504874
PNG
(8-fluoro- 2-({3- fluoro-4-[5- (trifluoro- methyl)-...)
Show SMILES Fc1cc(COc2ccc3cccc(F)c3n2)ccc1-c1noc(n1)C(F)(F)F
Show InChI InChI=1S/C19H10F5N3O2/c20-13-3-1-2-11-5-7-15(25-16(11)13)28-9-10-4-6-12(14(21)8-10)17-26-18(29-27-17)19(22,23)24/h1-8H,9H2
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 7n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC5 reagents: N-terminal GST tagged HDAC5 was purchased from BPS Bioscience [catalog #50045]. Assays were performed with buffer containing 20 mM HE...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM505043
PNG
(N-phenyl- 3-[({5-[5- (trifluoro- methyl)- 1,2,4-ox...)
Show SMILES FC(F)(F)c1nc(no1)-c1ccc(CNc2cccc(c2)C(=O)Nc2ccccc2)nc1
Show InChI InChI=1S/C22H16F3N5O2/c23-22(24,25)21-29-19(30-32-21)15-9-10-18(26-12-15)13-27-17-8-4-5-14(11-17)20(31)28-16-6-2-1-3-7-16/h1-12,27H,13H2,(H,28,31)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 7n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504676
PNG
((S)-5- (benzo[d]oxazol- 2-yl)-1-(4-(5- (trifluorom...)
Show SMILES FC(F)(F)c1nc(no1)-c1ccc(cc1)N1[C@@H](CCC1=O)c1nc2ccccc2o1
Show InChI InChI=1S/C20H13F3N4O3/c21-20(22,23)19-25-17(26-30-19)11-5-7-12(8-6-11)27-14(9-10-16(27)28)18-24-13-3-1-2-4-15(13)29-18/h1-8,14H,9-10H2/t14-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 7.10n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504526
PNG
(US11066396, Example 8 | tert-Butyl(S)-1-(2,5-diflu...)
Show SMILES CC(C)(C)OC(=O)[C@@H]1CCC(=O)N1c1cc(F)c(cc1F)-c1noc(n1)C(F)(F)F
Show InChI InChI=1S/C18H16F5N3O4/c1-17(2,3)29-15(28)11-4-5-13(27)26(11)12-7-9(19)8(6-10(12)20)14-24-16(30-25-14)18(21,22)23/h6-7,11H,4-5H2,1-3H3/t11-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 7.20n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504686
PNG
((S)-5-(3-(pyridin-3- yl)-1,2,4-oxadiazol- 5-yl)-1-...)
Show SMILES FC(F)(F)c1nc(no1)-c1ccc(cc1)N1[C@@H](CCC1=O)c1nc(no1)-c1cccnc1
Show InChI InChI=1S/C20H13F3N6O3/c21-20(22,23)19-26-16(28-32-19)11-3-5-13(6-4-11)29-14(7-8-15(29)30)18-25-17(27-31-18)12-2-1-9-24-10-12/h1-6,9-10,14H,7-8H2/t14-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 7.20n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504586
PNG
(6-(3-phenyl-1,2,4- oxadiazol-5-yl)-1- (4-(5- (trif...)
Show SMILES FC(F)(F)c1nc(no1)-c1ccc(cc1)N1C(CCCC1=O)c1nc(no1)-c1ccccc1
Show InChI InChI=1S/C22H16F3N5O3/c23-22(24,25)21-27-19(29-33-21)14-9-11-15(12-10-14)30-16(7-4-8-17(30)31)20-26-18(28-32-20)13-5-2-1-3-6-13/h1-3,5-6,9-12,16H,4,7-8H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 7.30n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM505045
PNG
(2-[({5-[5- (trifluoro- methyl)- 1,2,4-oxa- diazol-...)
Show SMILES NC(=O)c1ccnc(NCc2ccc(cn2)-c2noc(n2)C(F)(F)F)c1
Show InChI InChI=1S/C15H11F3N6O2/c16-15(17,18)14-23-13(24-26-14)9-1-2-10(21-6-9)7-22-11-5-8(12(19)25)3-4-20-11/h1-6H,7H2,(H2,19,25)(H,20,22)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 7.30n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504621
PNG
(N-(3- fluorophenyl)-2- isopropyl-N-((5- (5-(triflu...)
Show SMILES CC(C)c1ncc(cn1)C(=O)N(Cc1ccc(cn1)-c1noc(n1)C(F)(F)F)c1cccc(F)c1
Show InChI InChI=1S/C23H18F4N6O2/c1-13(2)19-29-10-15(11-30-19)21(34)33(18-5-3-4-16(24)8-18)12-17-7-6-14(9-28-17)20-31-22(35-32-20)23(25,26)27/h3-11,13H,12H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 7.30n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504545
PNG
((S)?N-(tert-Butyl)-1-(2,5-difluoro-4-(5-(trifluoro...)
Show SMILES CN(C(=O)[C@@H]1CCC(=O)N1c1cc(F)c(cc1F)-c1noc(n1)C(F)(F)F)C(C)(C)C
Show InChI InChI=1S/C19H19F5N4O3/c1-18(2,3)27(4)16(30)12-5-6-14(29)28(12)13-8-10(20)9(7-11(13)21)15-25-17(31-26-15)19(22,23)24/h7-8,12H,5-6H2,1-4H3/t12-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 7.5n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504545
PNG
((S)?N-(tert-Butyl)-1-(2,5-difluoro-4-(5-(trifluoro...)
Show SMILES CN(C(=O)[C@@H]1CCC(=O)N1c1cc(F)c(cc1F)-c1noc(n1)C(F)(F)F)C(C)(C)C
Show InChI InChI=1S/C19H19F5N4O3/c1-18(2,3)27(4)16(30)12-5-6-14(29)28(12)13-8-10(20)9(7-11(13)21)15-25-17(31-26-15)19(22,23)24/h7-8,12H,5-6H2,1-4H3/t12-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 7.5n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 1


(Homo sapiens (Human))
BDBM504958
PNG
(3-(1,3- oxazol- 5-yl)- N-({5-[5- (trifluoro- methy...)
Show SMILES FC(F)(F)c1nc(no1)-c1ccc(CNc2cccc(c2)-c2cnco2)nc1
Show InChI InChI=1S/C18H12F3N5O2/c19-18(20,21)17-25-16(26-28-17)12-4-5-14(23-7-12)8-24-13-3-1-2-11(6-13)15-9-22-10-27-15/h1-7,9-10,24H,8H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 7.60n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504687
PNG
((S)-5-(3-(pyridin-4- yl)-1,2,4-oxadiazol- 5-yl)-1-...)
Show SMILES FC(F)(F)c1nc(no1)-c1ccc(cc1)N1[C@@H](CCC1=O)c1nc(no1)-c1ccncc1
Show InChI InChI=1S/C20H13F3N6O3/c21-20(22,23)19-26-17(28-32-19)11-1-3-13(4-2-11)29-14(5-6-15(29)30)18-25-16(27-31-18)12-7-9-24-10-8-12/h1-4,7-10,14H,5-6H2/t14-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 7.60n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM505000
PNG
(2-(1,1- dioxido- tetrahydro- thiophen- 3-yl)-N- (3...)
Show SMILES Fc1cccc(c1)N(Cc1ccc(cn1)-c1noc(n1)C(F)(F)F)C(=O)CC1CCS(=O)(=O)C1
Show InChI InChI=1S/C21H18F4N4O4S/c22-15-2-1-3-17(9-15)29(18(30)8-13-6-7-34(31,32)12-13)11-16-5-4-14(10-26-16)19-27-20(33-28-19)21(23,24)25/h1-5,9-10,13H,6-8,11-12H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 7.70n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504623
PNG
(N-(3- fluorophenyl)-N- ((5-(5- (trifluoromethyl)- ...)
Show SMILES Fc1cccc(c1)N(Cc1ccc(cn1)-c1noc(n1)C(F)(F)F)C(=O)C1CCS(=O)(=O)C1
Show InChI InChI=1S/C20H16F4N4O4S/c21-14-2-1-3-16(8-14)28(18(29)13-6-7-33(30,31)11-13)10-15-5-4-12(9-25-15)17-26-19(32-27-17)20(22,23)24/h1-5,8-9,13H,6-7,10-11H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 7.80n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504957
PNG
(6-methyl- N-({5-[5- (trifluoro- methyl)- 1,2,4-oxa...)
Show SMILES Cc1ccc(NCc2ccc(cn2)-c2noc(n2)C(F)(F)F)cn1
Show InChI InChI=1S/C15H12F3N5O/c1-9-2-4-11(7-19-9)21-8-12-5-3-10(6-20-12)13-22-14(24-23-13)15(16,17)18/h2-7,21H,8H2,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 8n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504624
PNG
(N-(3- fluorophenyl)-N- ((5-(5- (trifluoromethyl)- ...)
Show SMILES Fc1cccc(c1)N(Cc1ccc(cn1)-c1noc(n1)C(F)(F)F)C(=O)C1CCS(=O)(=O)CC1
Show InChI InChI=1S/C21H18F4N4O4S/c22-15-2-1-3-17(10-15)29(19(30)13-6-8-34(31,32)9-7-13)12-16-5-4-14(11-26-16)18-27-20(33-28-18)21(23,24)25/h1-5,10-11,13H,6-9,12H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 8.10n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM504553
PNG
((S)-6-(Benzo[d]thiazol-2-yl)-1-(4-(5-(trifluoromet...)
Show SMILES FC(F)(F)c1nc(no1)-c1ccc(cc1)N1[C@@H](CCCC1=O)c1nc2ccccc2s1
Show InChI InChI=1S/C21H15F3N4O2S/c22-21(23,24)20-26-18(27-30-20)12-8-10-13(11-9-12)28-15(5-3-7-17(28)29)19-25-14-4-1-2-6-16(14)31-19/h1-2,4,6,8-11,15H,3,5,7H2/t15-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 8.10n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM505002
PNG
(N-(3-fluoro- phenyl)- 6-methyl- N-({5-[5- (trifluo...)
Show SMILES Cc1ccc(nn1)C(=O)N(Cc1ccc(cn1)-c1noc(n1)C(F)(F)F)c1cccc(F)c1
Show InChI InChI=1S/C21H14F4N6O2/c1-12-5-8-17(29-28-12)19(32)31(16-4-2-3-14(22)9-16)11-15-7-6-13(10-26-15)18-27-20(33-30-18)21(23,24)25/h2-10H,11H2,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
US Patent
n/an/a 8.20n/an/an/an/an/an/a



MERCK SHARP & DOHME CORP.

US Patent


Assay Description
HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...


US Patent US11066396 (2021)

More data for this
Ligand-Target Pair
Displayed 1 to 50 (of 1453 total )  |  Next  |  Last  >>
* indicates data uncertainty>20%