Alcohol

Alcohol

SCHEMBL10696050

CCO.Cc1ncc([N+](=O)[O-])[nH]1

nearest known ligand 0.45

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 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
MAPK1 P28482 2/20 0.39
LMNA P02545 2/20 0.39
THRB P10828 1/20 0.39
TSHR P16473 1/20 0.39
HRH1 P35367 1/20 0.36
HRH4 Q9H3N8 1/20 0.36
FDPS P14324 1/20 0.36
BAZ2B Q9UIF8 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
ATM Q13315 1/20 0.34
MAPT P10636 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CHRM1 P11229 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL1187005 0.90
SCHEMBL28809178 0.77
SCHEMBL11617678 0.77 ALDH1A1 (0.34) ALDH1A1MAPK1LMNATHRBTSHR
SCHEMBL8813561 0.76 GAA (0.42) ALDH1A1MAPK1SMN1; SMN2ATMMAPT
SCHEMBL31074740 0.74 ALDH1A1 (0.43) ALDH1A1MAPTGAA
Ethyl Nicotinate SCHEMBL7711056 0.73 L3MBTL1 (0.50) ALDH1A1MAPK1LMNATSHRMAPT
SCHEMBL5182829 0.73 TSHR (0.38) ALDH1A1MAPK1LMNATHRBTSHR
SCHEMBL9318283 0.73 KDM4C (0.38) ALDH1A1MAPK1LMNATSHRSMN1; SMN2
SCHEMBL9953612 0.73 MAPK1 (0.34) MAPK1ATMMAPTCHRM1
SCHEMBL5045818 0.73 MAPK1 (0.34) ALDH1A1MAPK1LMNATHRBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110448633-A The pharmaceutical composition and preparation method thereof for treating vaginitis LIU YUMEI 2019-11-15 CN claimed
EP-0176831-B1 FAST RESPONSE, HIGH RATE, GAS DIFFUSION ELECTRODE AND METHOD OF MAKING SAME ELTECH SYSTEMS CORPORATION (US) 1988-11-09 EP claimed
US-12285404-B2 Prevention of rosacea inflammation THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2025-04-29 US disclosed
US-20230181518-A1 PREVENTION OF ROSACEA INFLAMMATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-06-15 US disclosed
CN-110448633-A The pharmaceutical composition and preparation method thereof for treating vaginitis LIU YUMEI 2019-11-15 CN disclosed
CN-110448633-A The pharmaceutical composition and preparation method thereof for treating vaginitis LIU YUMEI 2019-11-15 CN disclosed
CN-209584043-U Metronidazole produces the conversion recyclable device containing formic acid wastewater HECHI JINXING BIOTECHNOLOGY CO LTD 2019-11-05 CN disclosed
CN-109776425-A The conversion recyclable device of formic acid solvent in metronidazole production process 河池市金兴生物科技有限公司 2019-05-21 CN disclosed
CN-103315995-B Use alpha-hydroxy carbonyl compounds as reducing agent 莫沃斯技术有限公司 2019-03-15 CN disclosed
CN-108593768-A One kind is for hush pipe weld seam detection platform in carbon tetrachloride processing equipment 徐州工程学院 2018-09-28 CN disclosed
CN-104297239-A Rapid detection kit and detection method for metronidazole in cosmetics ZHONGSHAN DINGSHENG BIOTECHNOLOGY CO LTD 2015-01-21 CN disclosed