Alcohol

Alcohol

SCHEMBL2553945

CCO.CCO.OCC(O)COCC(O)CO

nearest known ligand 0.58

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 15)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.58
KDM4E B2RXH2 4/20 0.48
LMNA P02545 4/20 0.44
ALDH1A1 P00352 2/20 0.44
CYP1A2 P05177 3/20 0.42
AGTR1 P30556 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
DUSP3 P51452 1/20 0.41
HSD17B10 Q99714 1/20 0.40
THRB P10828 1/20 0.36
HTT P42858 1/20 0.35
TSHR P16473 2/20 0.35
MAPK1 P28482 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
Propane SCHEMBL5154976 0.94 USP2 (0.58) USP2KDM4ELMNAALDH1A1CYP1A2
Methyl Alcohol SCHEMBL27869223 0.91 USP2 (0.54) USP2KDM4ELMNAALDH1A1CYP1A2
Ethane SCHEMBL2303498 0.91 USP2 (0.54) USP2KDM4ELMNAALDH1A1CYP1A2
SCHEMBL1638881 0.91 LMNA (0.53) USP2KDM4ELMNAALDH1A1CYP1A2
SCHEMBL30754 0.91 LMNA (0.53) USP2KDM4ELMNAALDH1A1CYP1A2
SCHEMBL1709058 0.89 USP2 (0.54) USP2KDM4ELMNAALDH1A1CYP1A2
Alcohol SCHEMBL12475875 0.89 USP2 (0.54) USP2KDM4ELMNAALDH1A1CYP1A2
Isobutane SCHEMBL27997158 0.88 USP2 (0.52) USP2KDM4ELMNAALDH1A1CYP1A2
Isopropyl Alcohol SCHEMBL7787253 0.88 USP2 (0.52) USP2KDM4ELMNAALDH1A1CYP1A2
SCHEMBL25238278 0.88 LMNA (0.50) USP2KDM4ELMNAALDH1A1CYP1A2

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-2011124146-A1 YEAST HAVING IMPROVED ETHANOL YIELD TIANJIN UNIVERSITY (CN) 2011-10-13 WO disclosed