Alcohol

Alcohol

SCHEMBL29018751

CCO.Oc1cccc(Cl)c1Cl.[NaH]

nearest known ligand 0.74

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 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.74
ALDH1A1 P00352 3/20 0.46
CYP3A4 P08684 4/20 0.44
MAPK1 P28482 2/20 0.44
AR P10275 1/20 0.43
KIF11 P52732 1/20 0.41
PNMT P11086 2/20 0.40
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
TAS1R2 Q8TE23 1/20 0.39
CYP1A2 P05177 2/20 0.38
CYP2D6 P10635 2/20 0.38
TP53 P04637 2/20 0.38
CYP2C19 P33261 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NFKB1 P19838 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
LMNA P02545 2/20 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
SCHEMBL5842280 0.89 TSHR (0.94) TSHRALDH1A1CYP3A4MAPK1AR
Ethane SCHEMBL27508988 0.86 TSHR (0.90) TSHRALDH1A1CYP3A4MAPK1AR
Methyl Alcohol SCHEMBL28055239 0.86 TSHR (0.90) TSHRALDH1A1CYP3A4MAPK1AR
SCHEMBL30631964 0.86
SCHEMBL134755 0.86
Ethane SCHEMBL27730863 0.84 TSHR (0.85) TSHRALDH1A1CYP3A4MAPK1AR
Methylene Chloride SCHEMBL29241646 0.84 TSHR (0.85) TSHRALDH1A1CYP3A4MAPK1AR
SCHEMBL31006506 0.84 TSHR (0.94) TSHRALDH1A1CYP3A4MAPK1AR
Methane SCHEMBL28589037 0.84 TSHR (0.94) TSHRALDH1A1CYP3A4MAPK1AR
Hydrochloric Acid SCHEMBL9797291 0.84 TSHR (0.94) TSHRALDH1A1CYP3A4MAPK1AR

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-116284852-A PH sensitive interpenetrating network hydrogel 广州医科大学附属肿瘤医院 2023-06-23 CN disclosed