CodeJ3O
NameFenofibrate
SynonymsFinofibrate
Identifierpropan-2-yl 2-[4-(4-chlorophenyl)carbonylphenoxy]-2-methyl-propanoate
FormulaC20 H21 Cl O4
Molecular Weight360.831
SMILESCC(C)OC(=O)C(C)(C)Oc1ccc(cc1)C(=O)c2ccc(cc2)Cl
PubChem3339
Formal Charge0
Total Atoms46
Total Chiral Atoms0
Total Bonds47
Total Aromatic Bonds12
Networks1
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This ligand is also present in the following network:
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8K8J A Lipid Cannabinoid CB1 Homo sapiens Fenofibrate - chim(Gs-CtGq)/Beta1/Gamma2 2.88 2024-02-14 10.1002/advs.202306311

A 2D representation of the interactions of J3O in 8K8J
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)
Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
R:R:E106 R:R:M109 8.12 3 No No 4 3 2 2
R:R:E106 R:R:F177 5.83 3 No Yes 4 4 2 1
R:R:F177 R:R:M109 6.22 3 Yes No 4 3 1 2
R:R:F174 R:R:I119 3.77 3 Yes No 5 5 1 2
R:R:F170 R:R:F174 12.86 3 Yes Yes 7 5 1 1
R:R:F170 R:R:S383 3.96 3 Yes No 7 6 1 2
R:R:F170 R:R:M384 4.98 3 Yes No 7 5 1 2
R:R:F170 R:R:L387 6.09 3 Yes No 7 7 1 2
L:L:?1 R:R:F170 8.24 3 Yes Yes 0 7 0 1
L:L:?1 R:R:S173 4.51 3 Yes No 0 4 0 1
R:R:F174 R:R:H178 10.18 3 Yes No 5 4 1 1
R:R:F174 R:R:S383 5.28 3 Yes No 5 6 1 2
R:R:F174 R:R:M384 3.73 3 Yes No 5 5 1 2
L:L:?1 R:R:F174 4.58 3 Yes Yes 0 5 0 1
R:R:D184 R:R:F177 7.17 0 No Yes 2 4 2 1
L:L:?1 R:R:F177 14.64 3 Yes Yes 0 4 0 1
L:L:?1 R:R:H178 8.69 3 Yes No 0 4 0 1
R:R:F268 R:R:L193 7.31 3 Yes No 5 4 1 1
L:L:?1 R:R:L193 7.28 3 Yes No 0 4 0 1
R:R:G194 R:R:T197 3.64 0 No No 6 6 2 1
L:L:?1 R:R:V196 8.95 3 Yes No 0 7 0 1
R:R:T197 R:R:W279 4.85 3 No Yes 6 6 1 1
L:L:?1 R:R:T197 7.75 3 Yes No 0 6 0 1
R:R:F200 R:R:S199 5.28 0 No No 7 7 1 2
R:R:C386 R:R:F200 5.59 0 No No 7 7 2 1
L:L:?1 R:R:F200 9.15 3 Yes No 0 7 0 1
R:R:T201 R:R:W279 10.92 0 No Yes 6 6 2 1
R:R:F268 R:R:I267 12.56 3 Yes No 5 4 1 2
R:R:F379 R:R:I267 11.3 3 Yes No 4 4 2 2
R:R:F268 R:R:I271 10.05 3 Yes Yes 5 3 1 2
L:L:?1 R:R:F268 12.81 3 Yes Yes 0 5 0 1
R:R:V283 R:R:W279 9.81 0 No Yes 8 6 2 1
L:L:?1 R:R:W279 17.97 3 Yes Yes 0 6 0 1
R:R:I280 R:R:M363 7.29 0 No Yes 5 6 2 1
R:R:L359 R:R:M363 4.24 3 No Yes 7 6 2 1
R:R:F379 R:R:L359 4.87 3 Yes No 4 7 2 2
R:R:C386 R:R:L359 4.76 0 No No 7 7 2 2
R:R:F379 R:R:M363 4.98 3 Yes Yes 4 6 2 1
L:L:?1 R:R:M363 6.37 3 Yes Yes 0 6 0 1
R:R:I169 R:R:V196 3.07 0 No No 5 7 2 1
R:R:A380 R:R:H178 2.93 0 No No 4 4 2 1
StatisticsValue
Average Number Of Links12.00
Average Number Of Links With An Hub6.00
Average Interaction Strength9.25
Average Nodes In Shell32.00
Average Hubs In Shell9.00
Average Links In Shell41.00
Average Links Mediated by Hubs In Shell34.00
Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)
Location of the nodes interacting with this ligand (click to enlarge 🔍)
StatisticsValue
Average Number Of Links12.00
Average Number Of Links With An Hub6.00
Average Interaction Strength9.25
Average Nodes In Shell32.00
Average Hubs In Shell9.00
Average Links In Shell41.00
Average Links Mediated by Hubs In Shell34.00

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Physico-chemical properties of the nodes interacting with this ligand

(Click to enlarge 🔍)

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Location of the nodes interacting with this ligand

(Click to enlarge 🔍)