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USPatent US8580778

Compile data set for download or QSAR
Found 9 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/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Hypoxia-inducible factor prolyl hydroxylase 4 (HIF)


(Homo sapiens (Human))
BDBM105221
PNG
(US8580778, 21)
Show SMILES FC1(F)CN(C1)c1cc(ncn1)-n1[nH]cc(-n2cc(nn2)C#N)c1=O
Show InChI InChI=1S/C13H9F2N9O/c14-13(15)5-22(6-13)10-1-11(18-7-17-10)24-12(25)9(3-19-24)23-4-8(2-16)20-21-23/h1,3-4,7,19H,5-6H2
KEGG

UniProtKB/SwissProt

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UniChem

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US Patent
n/an/a 70n/an/an/an/an/an/a



Bayer Intellectual Property GmbH

US Patent


Assay Description
In vitro tests for determination of the activity and selectivity of HIF prolyl 4-hydroxylase inhibitors. Hydroxylated HIF bonds specifically to the ...


US Patent US8580778 (2013)


BindingDB Entry DOI: 10.7270/Q21C1VH5
More data for this
Ligand-Target Pair
Hypoxia-inducible factor prolyl hydroxylase 4 (HIF)


(Homo sapiens (Human))
BDBM105220
PNG
(US8580778, 20)
Show SMILES FC1(F)CN(C1)c1cc(ncn1)-n1[nH]cc(-n2cnc(c2)C#N)c1=O
Show InChI InChI=1S/C14H10F2N8O/c15-14(16)5-23(6-14)11-1-12(19-7-18-11)24-13(25)10(3-21-24)22-4-9(2-17)20-8-22/h1,3-4,7-8,21H,5-6H2
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

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US Patent
n/an/a 90n/an/an/an/an/an/a



Bayer Intellectual Property GmbH

US Patent


Assay Description
In vitro tests for determination of the activity and selectivity of HIF prolyl 4-hydroxylase inhibitors. Hydroxylated HIF bonds specifically to the ...


US Patent US8580778 (2013)


BindingDB Entry DOI: 10.7270/Q21C1VH5
More data for this
Ligand-Target Pair
Hypoxia-inducible factor prolyl hydroxylase 4 (HIF)


(Homo sapiens (Human))
BDBM105219
PNG
(US8580778, 17)
Show SMILES FC1(F)CCN(C1)c1cc(ncn1)-n1[nH]cc(-n2cc(nn2)C#N)c1=O
Show InChI InChI=1S/C14H11F2N9O/c15-14(16)1-2-23(7-14)11-3-12(19-8-18-11)25-13(26)10(5-20-25)24-6-9(4-17)21-22-24/h3,5-6,8,20H,1-2,7H2
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

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US Patent
n/an/a 130n/an/an/an/an/an/a



Bayer Intellectual Property GmbH

US Patent


Assay Description
In vitro tests for determination of the activity and selectivity of HIF prolyl 4-hydroxylase inhibitors. Hydroxylated HIF bonds specifically to the ...


US Patent US8580778 (2013)


BindingDB Entry DOI: 10.7270/Q21C1VH5
More data for this
Ligand-Target Pair
Hypoxia-inducible factor prolyl hydroxylase 4 (HIF)


(Homo sapiens (Human))
BDBM105224
PNG
(US8580778, 29)
Show SMILES O=c1c(c[nH]n1-c1cc(ncn1)N1CCCCO1)-n1cc(nn1)C#N
Show InChI InChI=1S/C14H13N9O2/c15-6-10-8-21(20-19-10)11-7-18-23(14(11)24)13-5-12(16-9-17-13)22-3-1-2-4-25-22/h5,7-9,18H,1-4H2
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 170n/an/an/an/an/an/a



Bayer Intellectual Property GmbH

US Patent


Assay Description
In vitro tests for determination of the activity and selectivity of HIF prolyl 4-hydroxylase inhibitors. Hydroxylated HIF bonds specifically to the ...


US Patent US8580778 (2013)


BindingDB Entry DOI: 10.7270/Q21C1VH5
More data for this
Ligand-Target Pair
Hypoxia-inducible factor prolyl hydroxylase 4 (HIF)


(Homo sapiens (Human))
BDBM105222
PNG
(US8580778, 25)
Show SMILES O=c1c(c[nH]n1-c1cc(ncn1)N1CCCOCC1)-n1cnc(c1)C#N
Show InChI InChI=1S/C16H16N8O2/c17-7-12-9-23(11-20-12)13-8-21-24(16(13)25)15-6-14(18-10-19-15)22-2-1-4-26-5-3-22/h6,8-11,21H,1-5H2
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

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US Patent
n/an/a 180n/an/an/an/an/an/a



Bayer Intellectual Property GmbH

US Patent


Assay Description
In vitro tests for determination of the activity and selectivity of HIF prolyl 4-hydroxylase inhibitors. Hydroxylated HIF bonds specifically to the ...


US Patent US8580778 (2013)


BindingDB Entry DOI: 10.7270/Q21C1VH5
More data for this
Ligand-Target Pair
Hypoxia-inducible factor prolyl hydroxylase 4 (HIF)


(Homo sapiens (Human))
BDBM105223
PNG
(US8580778, 26)
Show SMILES O=c1c(c[nH]n1-c1cc(ncn1)N1CCCOCC1)-n1cc(nn1)C#N
Show InChI InChI=1S/C15H15N9O2/c16-7-11-9-23(21-20-11)12-8-19-24(15(12)25)14-6-13(17-10-18-14)22-2-1-4-26-5-3-22/h6,8-10,19H,1-5H2
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 380n/an/an/an/an/an/a



Bayer Intellectual Property GmbH

US Patent


Assay Description
In vitro tests for determination of the activity and selectivity of HIF prolyl 4-hydroxylase inhibitors. Hydroxylated HIF bonds specifically to the ...


US Patent US8580778 (2013)


BindingDB Entry DOI: 10.7270/Q21C1VH5
More data for this
Ligand-Target Pair
Hypoxia-inducible factor prolyl hydroxylase 4 (HIF)


(Homo sapiens (Human))
BDBM105217
PNG
(US8580778, 5)
Show SMILES OC(=O)C1CN(C1)c1cc(ncn1)-n1[nH]cc(-n2ccnc2)c1=O
Show InChI InChI=1S/C14H13N7O3/c22-13-10(19-2-1-15-8-19)4-18-21(13)12-3-11(16-7-17-12)20-5-9(6-20)14(23)24/h1-4,7-9,18H,5-6H2,(H,23,24)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 540n/an/an/an/an/an/a



Bayer Intellectual Property GmbH

US Patent


Assay Description
In vitro tests for determination of the activity and selectivity of HIF prolyl 4-hydroxylase inhibitors. Hydroxylated HIF bonds specifically to the ...


US Patent US8580778 (2013)


BindingDB Entry DOI: 10.7270/Q21C1VH5
More data for this
Ligand-Target Pair
Hypoxia-inducible factor prolyl hydroxylase 4 (HIF)


(Homo sapiens (Human))
BDBM105218
PNG
(US8580778, 9)
Show SMILES CN(C)C1CN(C1)c1cc(ncn1)-n1[nH]cc(-n2ccnn2)c1=O
Show InChI InChI=1S/C14H17N9O/c1-20(2)10-7-21(8-10)12-5-13(16-9-15-12)23-14(24)11(6-18-23)22-4-3-17-19-22/h3-6,9-10,18H,7-8H2,1-2H3
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 760n/an/an/an/an/an/a



Bayer Intellectual Property GmbH

US Patent


Assay Description
In vitro tests for determination of the activity and selectivity of HIF prolyl 4-hydroxylase inhibitors. Hydroxylated HIF bonds specifically to the ...


US Patent US8580778 (2013)


BindingDB Entry DOI: 10.7270/Q21C1VH5
More data for this
Ligand-Target Pair
Hypoxia-inducible factor prolyl hydroxylase 4 (HIF)


(Homo sapiens (Human))
BDBM105216
PNG
(US8580778, 2)
Show SMILES O=c1c(c[nH]n1-c1cc(ncn1)N1CCN(CC1)C1CCC1)-n1ccnn1
Show InChI InChI=1S/C17H21N9O/c27-17-14(25-5-4-20-22-25)11-21-26(17)16-10-15(18-12-19-16)24-8-6-23(7-9-24)13-2-1-3-13/h4-5,10-13,21H,1-3,6-9H2
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 880n/an/an/an/an/an/a



Bayer Intellectual Property GmbH

US Patent


Assay Description
In vitro tests for determination of the activity and selectivity of HIF prolyl 4-hydroxylase inhibitors. Hydroxylated HIF bonds specifically to the ...


US Patent US8580778 (2013)


BindingDB Entry DOI: 10.7270/Q21C1VH5
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%