Sugi Predict

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Coenzyme_A

Coenzyme_A

SCHEMBL2833078

CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(=O)NCCC(=O)NCCS.CCCCCCCCCCCCCC(=O)O

nearest known ligand 0.88

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ EP300 Q09472 3/20 0.88
▸ AURKA O14965 2/20 0.88
▸ CHAT P28329 2/20 0.88
▸ NAA50 Q9GZZ1 2/20 0.88
▸ KAT5 Q92993 2/20 0.88
▸ KAT2B Q92831 1/20 0.88
▸ CREBBP Q92793 1/20 0.67

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
Coenzyme_A SCHEMBL2833005 1.00 EP300 (0.88) EP300AURKACHATNAA50KAT5
Coenzyme_A SCHEMBL2831401 1.00 EP300 (0.88) EP300AURKACHATNAA50KAT5
Coenzyme_A SCHEMBL15969462 0.99 EP300 (0.89) EP300AURKACHATNAA50KAT5
Coenzyme_A SCHEMBL25285622 0.98 EP300 (0.92) EP300AURKACHATNAA50KAT5
Coenzyme_A SCHEMBL16974417 0.95 EP300 (0.87) EP300AURKACHATNAA50KAT5
Coenzyme_A SCHEMBL2486324 0.95 EP300 (0.89) EP300AURKACHATNAA50KAT5
Coenzyme_A SCHEMBL16974425 0.95 EP300 (0.88) EP300AURKACHATNAA50KAT5
Coenzyme_A SCHEMBL88057 0.95 EP300 (0.88) EP300AURKACHATNAA50KAT5
Coenzyme_A SCHEMBL2119660 0.94 EP300 (0.90) EP300AURKACHATNAA50KAT5
Coenzyme_A SCHEMBL28724953 0.94 EP300 (0.90) EP300AURKACHATNAA50KAT5

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
WO-2010115578-A2 NOVEL COMPOUNDS SUITED AS DIESEL SUPPLEMENTS AND DIESEL SUBSTITUTES AND ROUTES FOR THEIR SYNTHESIS ETH ZURICH (CH) 2010-10-14 — — WO disclosed