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Compile Data Set for Download or QSAR

Found 232 hits with Last Name = 'kern' and Initial = 'o'   
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
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599596
PNG
(CHEMBL5191668)
Show SMILES CC(=O)Nc1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
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TBA



Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599618
PNG
(CHEMBL5182242)
Show SMILES OCC(=O)Nc1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599603
PNG
(CHEMBL5194835)
Show SMILES CNC(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CC2)c1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599620
PNG
(CHEMBL5195505)
Show SMILES CS(=O)(=O)Nc1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599612
PNG
(CHEMBL5173406)
Show SMILES NC(=O)CNC(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CC2)c1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599624
PNG
(CHEMBL5208791)
Show SMILES CNc1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
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Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599613
PNG
(CHEMBL5202114)
Show SMILES O=C(Nc1cc(ccn1)-c1cc(Nc2ccccc2)cc(c1)C(=O)NCC1OCCO1)C1CC1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599594
PNG
(CHEMBL5171272)
Show SMILES CNC(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 alpha


(Homo sapiens (Human))
BDBM50599596
PNG
(CHEMBL5191668)
Show SMILES CC(=O)Nc1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599614
PNG
(CHEMBL5171867)
Show SMILES CN(C)CCNC(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CC2)c1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599604
PNG
(CHEMBL5208569)
Show SMILES CNC(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(C)=O)c1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599606
PNG
(CHEMBL5195735)
Show SMILES CNC(=O)c1cc(Nc2ccc(F)cc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 beta


(Homo sapiens)
BDBM50599594
PNG
(CHEMBL5171272)
Show SMILES CNC(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599615
PNG
(CHEMBL5203228)
Show SMILES CN(C)CCCNC(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CC2)c1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599622
PNG
(CHEMBL5208135)
Show SMILES CN(C)CCOc1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617543
PNG
(US20230286943, Example 11)
Show SMILES CCn1nccc1C(=O)N[C@@H]([C@H]1CC[C@H](C)CC1)C(=O)Nc1ccc(cn1)-c1c(C)cncc1C |r,wU:14.15,wD:11.12,10.10,(3.03,-5.53,;4.52,-5.93,;5.61,-4.84,;7.12,-5.16,;7.89,-3.83,;6.86,-2.68,;5.45,-3.31,;4.12,-2.54,;2.78,-3.31,;4.12,-1,;2.78,-.23,;2.78,1.31,;4.12,2.08,;4.12,3.62,;2.78,4.39,;2.78,5.93,;1.45,3.62,;1.45,2.08,;1.45,-1,;1.45,-2.54,;.11,-.23,;-1.22,-1,;-1.22,-2.54,;-2.55,-3.31,;-3.89,-2.54,;-3.89,-1,;-2.55,-.23,;-5.22,-3.31,;-6.55,-2.54,;-6.55,-1,;-7.89,-3.31,;-7.89,-4.85,;-6.55,-5.62,;-5.22,-4.85,;-3.89,-5.62,)|
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Citation and Details

BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599623
PNG
(CHEMBL5171431)
Show SMILES CN1CCN(Cc2cc(Nc3ccccc3)cc(c2)-c2ccnc(NC(=O)C3CCOCC3)c2)CC1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599621
PNG
(CHEMBL5191055)
Show SMILES CNS(=O)(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617538
PNG
(US20230286943, Example 6)
Show SMILES C[C@H]1CC[C@@H](CC1)[C@H](NC(=O)c1ccnn1C)C(=O)Nc1ccc(cc1)-c1c(C)n[nH]c1C |r,wU:1.0,wD:7.8,4.4,(2.67,5.9,;2.67,4.36,;4,3.59,;4,2.05,;2.67,1.28,;1.33,2.05,;1.33,3.59,;2.67,-.26,;4,-1.03,;4,-2.57,;2.67,-3.34,;5.33,-3.34,;6.74,-2.71,;7.77,-3.86,;7,-5.19,;5.5,-4.87,;4.35,-5.9,;1.33,-1.03,;1.33,-2.57,;,-.26,;-1.33,-1.03,;-2.67,-.26,;-4,-1.03,;-4,-2.57,;-2.67,-3.34,;-1.33,-2.57,;-5.33,-3.34,;-6.74,-2.71,;-7.06,-1.21,;-7.77,-3.86,;-7,-5.19,;-5.5,-4.87,;-4.35,-5.9,)|
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Citation and Details

BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617626
PNG
(US20230286943, Example 94)
Show SMILES CCc1nocc1C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ccc(cn1)-c1c(Cl)cnn1C |r|
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Citation and Details

BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617633
PNG
(US20230286943, Example 101)
Show SMILES Cn1nccc1C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ccc(cn1)-c1c(CO)cnn1C |r|
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Citation and Details

BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617671
PNG
(US20230286943, Example 139)
Show SMILES Cc1cnn(C)c1-c1ccc(NC(=O)C(NC(=O)c2ccnn2C)C2C3(CC3)CCC22CC2)nc1
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Citation and Details

BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599617
PNG
(CHEMBL5198244)
Show SMILES CNC(=O)c1cc(Nc2ccc(F)cc2)cc(c1)-c1cc(NC(=O)C2CCOCC2)ncn1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 beta


(Homo sapiens)
BDBM50599596
PNG
(CHEMBL5191668)
Show SMILES CC(=O)Nc1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599595
PNG
(CHEMBL5206569)
Show SMILES CN(CC1OCCO1)C(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CC2)c1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617642
PNG
(US20230286943, Example 110)
Show SMILES CC(C)c1nocc1C(=O)N[C@@H]([C@H]1CC[C@H](C)CC1)C(=O)Nc1ccc(cn1)-c1c(C)cnn1C |r,wU:15.16,wD:11.11,12.19,(3.59,-3.34,;5.1,-3.68,;5.56,-5.15,;6.14,-2.55,;7.64,-2.87,;8.41,-1.54,;7.38,-.39,;5.98,-1.02,;4.64,-.25,;4.64,1.29,;3.31,-1.02,;1.98,-.25,;1.98,1.29,;3.31,2.06,;3.31,3.6,;1.98,4.37,;1.98,5.91,;.64,3.6,;.64,2.06,;.64,-1.02,;.64,-2.56,;-.69,-.25,;-2.02,-1.02,;-2.02,-2.56,;-3.36,-3.33,;-4.69,-2.56,;-4.69,-1.02,;-3.36,-.25,;-5.98,-3.41,;-6.14,-4.94,;-4.95,-5.91,;-7.64,-5.26,;-8.41,-3.92,;-7.38,-2.78,;-7.74,-1.28,)|
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Citation and Details

BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617627
PNG
(US20230286943, Example 95)
Show SMILES CCn1nccc1C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ccc(cn1)-c1c(Cl)cnn1C |r|
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Citation and Details

BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617578
PNG
(US20230286943, Example 46)
Show SMILES CCc1nocc1C(=O)N[C@@H]([C@H]1CC[C@H](C)CC1)C(=O)Nc1ccc(cn1)-c1c(C)cnn1C |r,wU:14.15,wD:10.10,11.12,(3.55,-3.12,;5.02,-3.59,;6.16,-2.56,;7.67,-2.88,;8.44,-1.55,;7.41,-.4,;6,-1.03,;4.67,-.26,;4.67,1.28,;3.33,-1.03,;2,-.26,;2,1.28,;3.33,2.05,;3.33,3.59,;2,4.36,;2,5.9,;.67,3.59,;.67,2.05,;.67,-1.03,;.67,-2.57,;-.67,-.26,;-2,-1.03,;-2,-2.57,;-3.33,-3.34,;-4.67,-2.57,;-4.67,-1.03,;-3.33,-.26,;-6,-3.34,;-6.16,-4.87,;-5.02,-5.9,;-7.67,-5.19,;-8.44,-3.86,;-7.41,-2.71,;-7.73,-1.21,)|
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Citation and Details

BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617575
PNG
(US20230286943, Example 43)
Show SMILES CCc1nocc1C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ccc(cn1)-c1c(C)noc1C |r|
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Citation and Details

BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617574
PNG
(US20230286943, Example 42)
Show SMILES CC(C)n1nccc1C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ccc(cn1)-c1c(C)noc1C |r|
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Citation and Details

BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617573
PNG
(US20230286943, Example 41)
Show SMILES CCn1nccc1C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ccc(cn1)-c1c(C)noc1C |r|
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Citation and Details

BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599593
PNG
(CHEMBL4303547)
Show SMILES NC(=O)c1nc(Nc2ccccc2)sc1NC(=O)C1CCCCC1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599602
PNG
(CHEMBL5203889)
Show SMILES CNC(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOC2)c1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 beta


(Homo sapiens)
BDBM50599595
PNG
(CHEMBL5206569)
Show SMILES CN(CC1OCCO1)C(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CC2)c1
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Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599607
PNG
(CHEMBL5186780)
Show SMILES CNC(=O)c1cc(Nc2cccc(F)c2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617577
PNG
(US20230286943, Example 45)
Show SMILES CCn1nccc1C(=O)N[C@@H]([C@H]1CC[C@H](C)CC1)C(=O)Nc1ccc(cn1)-c1c(C)cnn1C |r,wU:14.15,wD:10.10,11.12,(3.55,-3.12,;5.02,-3.59,;6.16,-2.56,;7.67,-2.88,;8.44,-1.55,;7.41,-.4,;6,-1.03,;4.67,-.26,;4.67,1.28,;3.33,-1.03,;2,-.26,;2,1.28,;3.33,2.05,;3.33,3.59,;2,4.36,;2,5.9,;.67,3.59,;.67,2.05,;.67,-1.03,;.67,-2.57,;-.67,-.26,;-2,-1.03,;-2,-2.57,;-3.33,-3.34,;-4.67,-2.57,;-4.67,-1.03,;-3.33,-.26,;-6,-3.34,;-6.16,-4.87,;-5.02,-5.9,;-7.67,-5.19,;-8.44,-3.86,;-7.41,-2.71,;-7.73,-1.21,)|
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BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617547
PNG
(US20230286943, Example 15)
Show SMILES C[C@H]1CC[C@@H](CC1)[C@H](NC(=O)c1ccnn1C)C(=O)Nc1ccc(cc1)-c1c(C)noc1C |r,wU:1.0,wD:4.7,7.8,(2,5.9,;2,4.36,;3.33,3.59,;3.33,2.05,;2,1.28,;.67,2.05,;.67,3.59,;2,-.26,;3.33,-1.03,;4.67,-.26,;4.67,1.28,;6,-1.03,;7.41,-.4,;8.44,-1.55,;7.67,-2.88,;6.16,-2.56,;5.02,-3.59,;.67,-1.03,;.67,-2.57,;-.67,-.26,;-2,-1.03,;-3.33,-.26,;-4.67,-1.03,;-4.67,-2.57,;-3.33,-3.34,;-2,-2.57,;-6,-3.34,;-7.41,-2.71,;-7.73,-1.21,;-8.44,-3.86,;-7.67,-5.19,;-6.16,-4.87,;-5.02,-5.9,)|
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BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617544
PNG
(US20230286943, Example 12)
Show SMILES C[C@H]1CC[C@@H](CC1)[C@H](NC(=O)c1ccnn1C)C(=O)Nc1ccc(cc1)C1CCOCC1 |r,wU:1.0,wD:4.3,7.8,(2.12,5.78,;2.12,4.23,;3.45,3.47,;3.45,1.93,;2.12,1.15,;.78,1.93,;.78,3.47,;2.12,-.38,;3.45,-1.15,;4.78,-.38,;4.78,1.15,;6.12,-1.15,;6.28,-2.69,;7.78,-3.01,;8.55,-1.67,;7.52,-.53,;7.92,.96,;.78,-1.15,;.78,-2.69,;-.55,-.38,;-1.89,-1.15,;-1.89,-2.69,;-3.22,-3.47,;-4.55,-2.69,;-4.55,-1.15,;-3.22,-.38,;-5.89,-3.47,;-7.22,-2.69,;-8.55,-3.47,;-8.55,-5,;-7.22,-5.78,;-5.89,-5,)|
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Citation and Details

BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 alpha


(Homo sapiens (Human))
BDBM50599595
PNG
(CHEMBL5206569)
Show SMILES CN(CC1OCCO1)C(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CC2)c1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617534
PNG
(US20230286943, Example 2)
Show SMILES C[C@H]1CC[C@@H](CC1)[C@H](NC(=O)c1ccnn1C)C(=O)Nc1ccc(c(F)c1)-c1ccc(=O)n(C)c1C |r,wU:1.0,wD:4.7,7.8,(2.74,5.84,;2.74,4.3,;4.08,3.53,;4.08,1.99,;2.74,1.22,;1.41,1.99,;1.41,3.53,;2.78,-.31,;4.11,-1.08,;5.45,-.31,;5.45,1.23,;6.78,-1.08,;6.94,-2.62,;8.45,-2.94,;9.22,-1.6,;8.19,-.46,;8.48,1.05,;1.44,-1.08,;1.44,-2.62,;.11,-.31,;-1.22,-1.08,;-1.22,-2.62,;-2.56,-3.39,;-3.89,-2.62,;-3.89,-1.08,;-5.22,-.31,;-2.56,-.31,;-5.2,-3.44,;-5.2,-4.98,;-6.53,-5.75,;-7.87,-4.98,;-9.14,-5.84,;-7.87,-3.44,;-9.22,-2.69,;-6.53,-2.67,;-6.53,-1.13,)|
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BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617535
PNG
(US20230286943, Example 3)
Show SMILES C[C@H]1CC[C@@H](CC1)[C@H](NC(=O)c1ccnn1C)C(=O)Nc1ccc(cc1)-c1c[nH]c(=O)c2[nH]ccc12 |r,wU:1.0,wD:7.8,4.4,(2.78,6.61,;2.78,5.07,;4.12,4.3,;4.12,2.76,;2.78,1.99,;1.45,2.76,;1.45,4.3,;2.78,.45,;4.12,-.32,;5.45,.45,;5.45,1.99,;6.78,-.32,;6.94,-1.85,;8.45,-2.17,;9.22,-.84,;8.19,.31,;8.51,1.81,;1.45,-.32,;1.45,-1.86,;.11,.45,;-1.22,-.32,;-2.55,.45,;-3.89,-.32,;-3.89,-1.86,;-2.55,-2.63,;-1.22,-1.86,;-5.22,-2.63,;-6.55,-1.86,;-7.89,-2.63,;-7.89,-4.17,;-9.22,-4.94,;-6.55,-4.94,;-6.23,-6.45,;-4.7,-6.61,;-4.08,-5.2,;-5.22,-4.17,)|
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Citation and Details

BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617541
PNG
(US20230286943, Example 9)
Show SMILES C[C@H]1CC[C@@H](CC1)[C@H](NC(=O)c1ccnn1C)C(=O)Nc1ccc(cn1)-c1c(C)cncc1C |r,wU:1.0,wD:7.8,4.4,(2.78,5.9,;2.78,4.36,;4.12,3.59,;4.12,2.05,;2.78,1.28,;1.45,2.05,;1.45,3.59,;2.78,-.26,;4.12,-1.03,;4.12,-2.57,;2.78,-3.34,;5.45,-3.34,;6.86,-2.71,;7.89,-3.86,;7.12,-5.19,;5.61,-4.87,;4.47,-5.9,;1.45,-1.03,;1.45,-2.57,;.11,-.26,;-1.22,-1.03,;-1.22,-2.57,;-2.55,-3.34,;-3.89,-2.57,;-3.89,-1.03,;-2.55,-.26,;-5.22,-3.34,;-6.55,-2.57,;-6.55,-1.03,;-7.89,-3.34,;-7.89,-4.88,;-6.55,-5.65,;-5.22,-4.88,;-3.89,-5.65,)|
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BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617567
PNG
(US20230286943, Example 35)
Show SMILES Cc1nocc1C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ccc(cn1)-c1c(C)noc1C |r|
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BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617582
PNG
(US20230286943, Example 50)
Show SMILES C[C@H]1CC[C@@H](CC1)[C@H](NC(=O)c1conc1C)C(=O)Nc1ccc(cn1)-c1c(C)cnn1C |r,wU:1.0,wD:7.8,4.3,(2,5.9,;2,4.36,;3.33,3.59,;3.33,2.05,;2,1.28,;.67,2.05,;.67,3.59,;2,-.26,;3.33,-1.03,;4.67,-.26,;4.67,1.28,;6,-1.03,;7.41,-.4,;8.44,-1.55,;7.67,-2.88,;6.16,-2.56,;5.02,-3.59,;.67,-1.03,;.67,-2.57,;-.67,-.26,;-2,-1.03,;-2,-2.57,;-3.33,-3.34,;-4.67,-2.57,;-4.67,-1.03,;-3.33,-.26,;-6,-3.34,;-6.16,-4.87,;-5.02,-5.9,;-7.67,-5.19,;-8.44,-3.86,;-7.41,-2.71,;-7.73,-1.21,)|
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BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617587
PNG
(US20230286943, Example 55)
Show SMILES Cc1cnn(C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2conc2C)C2CCCCCC2)nc1 |r|
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BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617614
PNG
(US20230286943, Example 82)
Show SMILES CCn1nccc1C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ncc(cc1F)-c1c(C)noc1C |r|
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BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617615
PNG
(US20230286943, Example 83)
Show SMILES CCc1nocc1C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ncc(cc1F)-c1c(C)noc1C |r|
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BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617659
PNG
(US20230286943, Example 127)
Show SMILES CCn1nccc1C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ccc(nc1)-c1c(C)n[nH]c1C |r|
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BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Interleukin-17F


(Homo sapiens (Human))
BDBM617661
PNG
(US20230286943, Example 129)
Show SMILES CCc1nocc1C(=O)N[C@@H](C1CCCCCC1)C(=O)Nc1ccc(nc1)-c1c(C)n[nH]c1C |r|
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Citation and Details

BindingDB Entry DOI: 10.7270/Q2X92GFG
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma


(Homo sapiens (Human))
BDBM50599619
PNG
(CHEMBL5200538)
Show SMILES CN(C(C)=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
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Citation and Details

Article DOI: 10.1016/j.bmc.2021.116557
BindingDB Entry DOI: 10.7270/Q23J3J18
More data for this
Ligand-Target Pair
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