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Compile Data Set for Download or QSAR

Found 108 hits with Last Name = 'khandelwal' and Initial = 'n'   
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
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM632965
PNG
(US20230348453, Compound B3)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)nccc2Cl)cc(n1)N1CCN(CCO)CC1
PDB
MMDB

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n/an/a 1.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM13216
PNG
(BMS-354825 | CHEMBL1421 | DASATINIB | N-(2-Chloro-...)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)cccc2Cl)cc(n1)N1CCN(CCO)CC1
Show InChI InChI=1S/C22H26ClN7O2S/c1-14-4-3-5-16(23)20(14)28-21(32)17-13-24-22(33-17)27-18-12-19(26-15(2)25-18)30-8-6-29(7-9-30)10-11-31/h3-5,12-13,31H,6-11H2,1-2H3,(H,28,32)(H,24,25,26,27)
PDB
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PDB
n/an/a 1.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM632953
PNG
(US20230348453, Compound C1)
Show SMILES Cc1ccnc(C)c1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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n/an/a<1.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM632954
PNG
(US20230348453, Compound C2)
Show SMILES Cc1cccnc1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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PC sid
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n/an/a<1.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM632957
PNG
(US20230348453, Compound C5)
Show SMILES Cc1cncc(C)c1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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n/an/a<1.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM632956
PNG
(US20230348453, Compound C4)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)cncc2Cl)cc(n1)N1CCN(CCO)CC1
PDB
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n/an/a<1.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK1


(Homo sapiens (Human))
BDBM13216
PNG
(BMS-354825 | CHEMBL1421 | DASATINIB | N-(2-Chloro-...)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)cccc2Cl)cc(n1)N1CCN(CCO)CC1
Show InChI InChI=1S/C22H26ClN7O2S/c1-14-4-3-5-16(23)20(14)28-21(32)17-13-24-22(33-17)27-18-12-19(26-15(2)25-18)30-8-6-29(7-9-30)10-11-31/h3-5,12-13,31H,6-11H2,1-2H3,(H,28,32)(H,24,25,26,27)
NCI pathway
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n/an/a 1.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM632958
PNG
(US20230348453, Compound C6)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2cccnc2C)cc(n1)N1CCN(CCO)CC1
PDB
MMDB

KEGG

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n/an/a<1.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM632959
PNG
(US20230348453, Compound C7)
Show SMILES Cc1csc(Cl)c1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
PDB
MMDB

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n/an/a<1.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM632962
PNG
(US20230348453, Compound C10)
Show SMILES CN1CCN(CC1)c1cc(Nc2ncc(s2)C(=O)Nc2c(Cl)ccnc2C)nc(C)n1
PDB
MMDB

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UniChem
n/an/a<1.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM632963
PNG
(US20230348453, Compound C11)
Show SMILES Cc1nc(NCCO)cc(Nc2ncc(s2)C(=O)Nc2c(Cl)ccnc2C)n1
PDB
MMDB

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PC sid
UniChem
n/an/a<1.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM632965
PNG
(US20230348453, Compound B3)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)nccc2Cl)cc(n1)N1CCN(CCO)CC1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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antibodypedia
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PC cid
PC sid
UniChem
n/an/a 1.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM13216
PNG
(BMS-354825 | CHEMBL1421 | DASATINIB | N-(2-Chloro-...)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)cccc2Cl)cc(n1)N1CCN(CCO)CC1
Show InChI InChI=1S/C22H26ClN7O2S/c1-14-4-3-5-16(23)20(14)28-21(32)17-13-24-22(33-17)27-18-12-19(26-15(2)25-18)30-8-6-29(7-9-30)10-11-31/h3-5,12-13,31H,6-11H2,1-2H3,(H,28,32)(H,24,25,26,27)
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n/an/a 1.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM632955
PNG
(US20230348453, Compound C3)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)nccc2Br)cc(n1)N1CCN(CCO)CC1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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PC sid
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n/an/a 1.59n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM632960
PNG
(US20230348453, Compound C8)
Show SMILES Cc1nn(C)c(C)c1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
PDB
MMDB

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UniChem
n/an/a 2.96n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK2


(Homo sapiens (Human))
BDBM632979
PNG
(US20230348453, Compound D7)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2c(Cl)csc2Cl)cc(n1)N1CCN(CCO)CC1
UniProtKB/SwissProt

antibodypedia
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PC sid
UniChem
n/an/a 3.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK2


(Homo sapiens (Human))
BDBM13216
PNG
(BMS-354825 | CHEMBL1421 | DASATINIB | N-(2-Chloro-...)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)cccc2Cl)cc(n1)N1CCN(CCO)CC1
Show InChI InChI=1S/C22H26ClN7O2S/c1-14-4-3-5-16(23)20(14)28-21(32)17-13-24-22(33-17)27-18-12-19(26-15(2)25-18)30-8-6-29(7-9-30)10-11-31/h3-5,12-13,31H,6-11H2,1-2H3,(H,28,32)(H,24,25,26,27)
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n/an/a 3.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM632962
PNG
(US20230348453, Compound C10)
Show SMILES CN1CCN(CC1)c1cc(Nc2ncc(s2)C(=O)Nc2c(Cl)ccnc2C)nc(C)n1
PDB
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n/an/a 4.30n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM632963
PNG
(US20230348453, Compound C11)
Show SMILES Cc1nc(NCCO)cc(Nc2ncc(s2)C(=O)Nc2c(Cl)ccnc2C)n1
PDB
MMDB

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n/an/a 4.43n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM632959
PNG
(US20230348453, Compound C7)
Show SMILES Cc1csc(Cl)c1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
PDB
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n/an/a 5.02n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK3


(Homo sapiens)
BDBM13216
PNG
(BMS-354825 | CHEMBL1421 | DASATINIB | N-(2-Chloro-...)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)cccc2Cl)cc(n1)N1CCN(CCO)CC1
Show InChI InChI=1S/C22H26ClN7O2S/c1-14-4-3-5-16(23)20(14)28-21(32)17-13-24-22(33-17)27-18-12-19(26-15(2)25-18)30-8-6-29(7-9-30)10-11-31/h3-5,12-13,31H,6-11H2,1-2H3,(H,28,32)(H,24,25,26,27)
PDB
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n/an/a 6n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM632961
PNG
(US20230348453, Compound C9)
Show SMILES Cc1noc(C)c1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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UniChem
n/an/a 6.44n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK2


(Homo sapiens (Human))
BDBM632967
PNG
(N-(4-chloro-2-fluorothiophen-3-yl)-2- ((6-(4-(2-hy...)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2c(Cl)csc2F)cc(n1)N1CCN(CCO)CC1
UniProtKB/SwissProt

antibodypedia
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UniChem
n/an/a<10n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK2


(Homo sapiens (Human))
BDBM632968
PNG
(N-(2-chloro-4-(fluoromethyl)thiophen- 3-yl)-2-((6-...)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2c(CF)csc2Cl)cc(n1)N1CCN(CCO)CC1
UniProtKB/SwissProt

antibodypedia
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PC sid
UniChem
n/an/a<10n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK2


(Homo sapiens (Human))
BDBM632971
PNG
(N-(2-chloro-4-(fluoromethyl)thiophen- 3-yl)-2-((2-...)
Show SMILES CN1CCN(CC1)c1cc(Nc2ncc(s2)C(=O)Nc2c(CF)csc2Cl)nc(C)n1
UniProtKB/SwissProt

antibodypedia
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UniChem
n/an/a<10n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK2


(Homo sapiens (Human))
BDBM632973
PNG
(N-(2-chloro-4-(fluoromethyl)thiophen- 3-yl)-2-((2-...)
Show SMILES CN1CCCN(CC1)c1cc(Nc2ncc(s2)C(=O)Nc2c(CF)csc2Cl)nc(C)n1
UniProtKB/SwissProt

antibodypedia
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n/an/a<10n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK2


(Homo sapiens (Human))
BDBM632975
PNG
(N-(2-chloro-4- (difluoromethyl)thiophen-3-yl)-2-((...)
Show SMILES CN1CCN(CC1)c1cc(Nc2ncc(s2)C(=O)Nc2c(Cl)scc2C(F)F)nc(C)n1
UniProtKB/SwissProt

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n/an/a<10n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK2


(Homo sapiens (Human))
BDBM632978
PNG
(US20230348453, Compound D1)
Show SMILES Cc1scc(Cl)c1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
UniProtKB/SwissProt

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PC sid
UniChem
n/an/a 12.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK2


(Homo sapiens (Human))
BDBM632981
PNG
(US20230348453, Compound D9)
Show SMILES CN1CCN(CC1)c1cc(Nc2ncc(s2)C(=O)Nc2c(C)csc2Cl)nc(C)n1
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 12.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK1


(Homo sapiens (Human))
BDBM632981
PNG
(US20230348453, Compound D9)
Show SMILES CN1CCN(CC1)c1cc(Nc2ncc(s2)C(=O)Nc2c(C)csc2Cl)nc(C)n1
NCI pathway
KEGG

UniProtKB/SwissProt

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antibodypedia
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PC cid
PC sid
UniChem
n/an/a 12.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM632953
PNG
(US20230348453, Compound C1)
Show SMILES Cc1ccnc(C)c1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
PDB
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PC sid
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n/an/a 13n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK1


(Homo sapiens (Human))
BDBM632959
PNG
(US20230348453, Compound C7)
Show SMILES Cc1csc(Cl)c1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
NCI pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
n/an/a 13.4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM632954
PNG
(US20230348453, Compound C2)
Show SMILES Cc1cccnc1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
PDB
MMDB

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PC sid
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n/an/a 14.4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM632958
PNG
(US20230348453, Compound C6)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2cccnc2C)cc(n1)N1CCN(CCO)CC1
PDB
MMDB

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PC sid
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n/an/a 14.7n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK3


(Homo sapiens)
BDBM632979
PNG
(US20230348453, Compound D7)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2c(Cl)csc2Cl)cc(n1)N1CCN(CCO)CC1
PDB
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KEGG

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PC sid
UniChem
n/an/a 17.5n/an/an/an/an/an/a


TBA



Citation and Details
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Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM632956
PNG
(US20230348453, Compound C4)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)cncc2Cl)cc(n1)N1CCN(CCO)CC1
PDB
MMDB

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PC sid
UniChem
n/an/a 17.7n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK2


(Homo sapiens (Human))
BDBM632959
PNG
(US20230348453, Compound C7)
Show SMILES Cc1csc(Cl)c1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
UniProtKB/SwissProt

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n/an/a 17.7n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK2


(Homo sapiens (Human))
BDBM13216
PNG
(BMS-354825 | CHEMBL1421 | DASATINIB | N-(2-Chloro-...)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)cccc2Cl)cc(n1)N1CCN(CCO)CC1
Show InChI InChI=1S/C22H26ClN7O2S/c1-14-4-3-5-16(23)20(14)28-21(32)17-13-24-22(33-17)27-18-12-19(26-15(2)25-18)30-8-6-29(7-9-30)10-11-31/h3-5,12-13,31H,6-11H2,1-2H3,(H,28,32)(H,24,25,26,27)
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n/an/a<20n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK2


(Homo sapiens (Human))
BDBM632959
PNG
(US20230348453, Compound C7)
Show SMILES Cc1csc(Cl)c1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
UniProtKB/SwissProt

antibodypedia
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PC sid
UniChem
n/an/a<20n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK2


(Homo sapiens (Human))
BDBM632969
PNG
(N-(2-chloro-4- (difluoromethyl)thiophen-3-yl)-2-((...)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2c(Cl)scc2C(F)F)cc(n1)N1CCN(CCO)CC1
UniProtKB/SwissProt

antibodypedia
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UniChem
n/an/a<20n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK3


(Homo sapiens)
BDBM632969
PNG
(N-(2-chloro-4- (difluoromethyl)thiophen-3-yl)-2-((...)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2c(Cl)scc2C(F)F)cc(n1)N1CCN(CCO)CC1
PDB
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KEGG

UniProtKB/SwissProt

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PC sid
UniChem
n/an/a<20n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK3


(Homo sapiens)
BDBM632971
PNG
(N-(2-chloro-4-(fluoromethyl)thiophen- 3-yl)-2-((2-...)
Show SMILES CN1CCN(CC1)c1cc(Nc2ncc(s2)C(=O)Nc2c(CF)csc2Cl)nc(C)n1
PDB
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PC sid
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n/an/a<20n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK2


(Homo sapiens (Human))
BDBM632972
PNG
(N-(2-chloro-4-(fluoromethyl)thiophen- 3-yl)-2-((6-...)
Show SMILES CC1CN(CCN1C)c1cc(Nc2ncc(s2)C(=O)Nc2c(CF)csc2Cl)nc(C)n1
UniProtKB/SwissProt

antibodypedia
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PC sid
UniChem
n/an/a<20n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK2


(Homo sapiens (Human))
BDBM632974
PNG
(N-(2-chloro-4-(fluoromethyl)thiophen- 3-yl)-2-((2-...)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2c(CF)csc2Cl)cc(n1)N1CCNC(=O)C1
UniProtKB/SwissProt

antibodypedia
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PC sid
UniChem
n/an/a<20n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK3


(Homo sapiens)
BDBM632975
PNG
(N-(2-chloro-4- (difluoromethyl)thiophen-3-yl)-2-((...)
Show SMILES CN1CCN(CC1)c1cc(Nc2ncc(s2)C(=O)Nc2c(Cl)scc2C(F)F)nc(C)n1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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PC sid
UniChem
n/an/a<20n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK2


(Homo sapiens (Human))
BDBM632976
PNG
(N-(4-chloro-2-fluorothiophen-3-yl)-2- ((2-methyl-6...)
Show SMILES CN1CCN(CC1)c1cc(Nc2ncc(s2)C(=O)Nc2c(Cl)csc2F)nc(C)n1
UniProtKB/SwissProt

antibodypedia
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PC sid
UniChem
n/an/a<20n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK2


(Homo sapiens (Human))
BDBM632977
PNG
(N-(2-chloro-4- (difluoromethyl)thiophen-3-yl)-2-((...)
Show SMILES CC1CN(CCN1C)c1cc(Nc2ncc(s2)C(=O)Nc2c(Cl)scc2C(F)F)nc(C)n1
UniProtKB/SwissProt

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PC sid
UniChem
n/an/a<20n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase SIK1


(Homo sapiens (Human))
BDBM632980
PNG
(US20230348453, Compound D8)
Show SMILES CC(=O)N1CCN(CC1)c1cc(Nc2ncc(s2)C(=O)Nc2c(C)csc2Cl)nc(C)n1
NCI pathway
KEGG

UniProtKB/SwissProt

DrugBank
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PC cid
PC sid
UniChem
n/an/a 22.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM632960
PNG
(US20230348453, Compound C8)
Show SMILES Cc1nn(C)c(C)c1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
n/an/a 22.8n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM632961
PNG
(US20230348453, Compound C9)
Show SMILES Cc1noc(C)c1NC(=O)c1cnc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)s1
PDB
MMDB

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UniProtKB/SwissProt

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PC sid
UniChem
n/an/a 27.4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
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