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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 = 'BDBM325453'   
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))
BDBM325453
PNG
((R)-1-(4-(4-(1-(pentan-3- yl)-1H-pyrazol-4- yl)pyr...)
Show SMILES CC[C@@H](O)Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)C(CC)CC |r|
Show InChI InChI=1S/C21H27N7O/c1-4-17(5-2)27-12-16(10-24-27)21-20-7-8-22-28(20)14-19(25-21)15-9-23-26(11-15)13-18(29)6-3/h7-12,14,17-18,29H,4-6,13H2,1-3H3/t18-/m1/s1
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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))
BDBM325453
PNG
((R)-1-(4-(4-(1-(pentan-3- yl)-1H-pyrazol-4- yl)pyr...)
Show SMILES CC[C@@H](O)Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)C(CC)CC |r|
Show InChI InChI=1S/C21H27N7O/c1-4-17(5-2)27-12-16(10-24-27)21-20-7-8-22-28(20)14-19(25-21)15-9-23-26(11-15)13-18(29)6-3/h7-12,14,17-18,29H,4-6,13H2,1-3H3/t18-/m1/s1
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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))
BDBM325453
PNG
((R)-1-(4-(4-(1-(pentan-3- yl)-1H-pyrazol-4- yl)pyr...)
Show SMILES CC[C@@H](O)Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)C(CC)CC |r|
Show InChI InChI=1S/C21H27N7O/c1-4-17(5-2)27-12-16(10-24-27)21-20-7-8-22-28(20)14-19(25-21)15-9-23-26(11-15)13-18(29)6-3/h7-12,14,17-18,29H,4-6,13H2,1-3H3/t18-/m1/s1
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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