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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Non-receptor tyrosine-protein kinase TYK2' and Ligand = 'BDBM325484'   
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
Non-receptor tyrosine-protein kinase TYK2


(Homo sapiens (Human))
BDBM325484
PNG
((1-(2-(4-(4-(1-(pentan-3-yl)- 1H-pyrazol-4- yl)pyr...)
Show SMILES CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCN2CCC(CO)CC2)c1
Show InChI InChI=1S/C25H34N8O/c1-3-22(4-2)32-16-21(14-28-32)25-24-5-8-26-33(24)17-23(29-25)20-13-27-31(15-20)12-11-30-9-6-19(18-34)7-10-30/h5,8,13-17,19,22,34H,3-4,6-7,9-12,18H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Array BioPharma Inc.

US Patent


Assay Description
Compounds of Formula I were screened for their ability to inhibit Tyk2 using the general enzyme inhibition assay method, in which the assay mixture c...


US Patent US10189845 (2019)


BindingDB Entry DOI: 10.7270/Q2Z03B7Q
More data for this
Ligand-Target Pair
Non-receptor tyrosine-protein kinase TYK2


(Homo sapiens (Human))
BDBM325484
PNG
((1-(2-(4-(4-(1-(pentan-3-yl)- 1H-pyrazol-4- yl)pyr...)
Show SMILES CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCN2CCC(CO)CC2)c1
Show InChI InChI=1S/C25H34N8O/c1-3-22(4-2)32-16-21(14-28-32)25-24-5-8-26-33(24)17-23(29-25)20-13-27-31(15-20)12-11-30-9-6-19(18-34)7-10-30/h5,8,13-17,19,22,34H,3-4,6-7,9-12,18H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



ARRAY BIOPHARMA INC.; CELGENE CORPORATION

US Patent


Assay Description
Compounds of Formula I were screened for their ability to inhibit Tyk2 using the general enzyme inhibition assay method, in which the assay mixture c...


US Patent US11028093 (2021)


BindingDB Entry DOI: 10.7270/Q2T156RN
More data for this
Ligand-Target Pair
Non-receptor tyrosine-protein kinase TYK2


(Homo sapiens (Human))
BDBM325484
PNG
((1-(2-(4-(4-(1-(pentan-3-yl)- 1H-pyrazol-4- yl)pyr...)
Show SMILES CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCN2CCC(CO)CC2)c1
Show InChI InChI=1S/C25H34N8O/c1-3-22(4-2)32-16-21(14-28-32)25-24-5-8-26-33(24)17-23(29-25)20-13-27-31(15-20)12-11-30-9-6-19(18-34)7-10-30/h5,8,13-17,19,22,34H,3-4,6-7,9-12,18H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Array BioPharma Inc.; Celgene Corporation

US Patent


Assay Description
Compounds of Formula I were screened for their ability to inhibit Tyk2 using the general enzyme inhibition assay method, in which the assay mixture c...


US Patent US10730880 (2020)


BindingDB Entry DOI: 10.7270/Q2CC13R9
More data for this
Ligand-Target Pair