Alcohol

Alcohol

SCHEMBL4128420

CC(=O)OC(C)C(=O)O.CCO.O=COC(=O)CCC(=O)O

nearest known ligand 0.32

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Alcohol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM6B O15054 1/20 0.32
KDM5C P41229 1/20 0.32
EGLN1 Q9GZT9 1/20 0.32
PHF8 Q9UPP1 1/20 0.32
KDM2A Q9Y2K7 1/20 0.32
FOLH1 Q04609 1/20 0.31
CYP1A2 P05177 1/20 0.30

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
Pyruvate SCHEMBL7929357 0.96
Succinic Acid SCHEMBL6340677 0.86 LMNA (0.34) KDM6BKDM5CEGLN1PHF8KDM2A
Succinic Acid SCHEMBL15323172 0.82 EGLN1 (0.43) KDM6BKDM5CEGLN1PHF8KDM2A
Succinic Acid SCHEMBL9065587 0.80 LMNA (0.44) KDM6BKDM5CEGLN1PHF8KDM2A
Propionic Acid SCHEMBL8734266 0.77 FFAR3 (0.42) CYP1A2
Lactic Acid SCHEMBL4133671 0.77 ALDH1A1 (0.41) KDM6BKDM5CEGLN1PHF8KDM2A
Butyric Acid SCHEMBL10578465 0.76 FFAR3 (0.52) CYP1A2
Butane SCHEMBL7832973 0.75 FFAR3 (0.44) KDM6BKDM5CEGLN1PHF8KDM2A
SCHEMBL4377797 0.75 LMNA (0.47) KDM6BKDM5CEGLN1PHF8KDM2A
SCHEMBL935213 0.73 EGLN1 (0.45) KDM6BKDM5CEGLN1PHF8KDM2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2041293-A2 ETHANOL PRODUCTION IN NON-RECOMBINANT HOSTS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2009-04-01 EP disclosed
WO-2008018930-A2 ETHANOL PRODUCTION IN NON-RECOMBINANT HOSTS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2008-02-14 WO disclosed