Ethylbenzene

Ethylbenzene

SCHEMBL28675405

CCc1ccccc1.NS(N)(=O)=O

nearest known ligand 0.70

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.70
CA2 P00918 10/20 0.58
CA1 P00915 6/20 0.56
CA9 Q16790 5/20 0.56
CA5A P35218 2/20 0.56
CA12 O43570 3/20 0.50
CA14 Q9ULX7 3/20 0.50
CA7 P43166 2/20 0.50
PSIP1 O75475 1/20 0.46
FAAH O00519 1/20 0.44
PRSS1 P07477 1/20 0.44
PRSS2 P07478 1/20 0.44
ELANE P08246 1/20 0.44
PRTN3 P24158 1/20 0.44
PRSS3 P35030 1/20 0.44
CA3 P07451 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
PLA2G7 Q13093 1/20 0.44
CA13 Q8N1Q1 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Ethylbenzene SCHEMBL11127609 0.91 TP53 (0.64) TP53CA2CA1CA9CA5A
Ethylbenzene SCHEMBL9131401 0.87 TP53 (0.58) TP53CA2CA1CA9CA5A
Ethylbenzene SCHEMBL6362282 0.85 TP53 (0.70) TP53CA2CA1CA9CA5A
Ethylbenzene SCHEMBL1818291 0.85 TP53 (0.70) TP53CA2CA1CA9CA5A
Ethylbenzene SCHEMBL10386570 0.85 TP53 (0.70) TP53CA2CA1CA9CA5A
Ethylbenzene SCHEMBL9618498 0.84 TP53 (0.88) TP53
Ethylbenzene SCHEMBL1312847 0.84 TP53 (0.88) TP53
Ethylbenzene SCHEMBL11223212 0.84 TP53 (1.00) TP53
Ethylbenzene SCHEMBL1332452 0.84
Ethylbenzene SCHEMBL3987542 0.84 TP53 (1.00) TP53

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113897603-A Corrosion-resistant palladium electroless plating solution and application thereof 信丰正天伟电子科技有限公司 2022-01-07 CN disclosed