Alcohol

Alcohol

SCHEMBL14697141

C=C(C)C(=O)Oc1ccc(C(=O)c2ccc(Br)cc2)cc1.CCO

nearest known ligand 0.66

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
ELANE P08246 7/20 0.66
KMT2A Q03164 2/20 0.53
LMNA P02545 2/20 0.53
MEN1 O00255 1/20 0.53
MAPT P10636 1/20 0.53
MAPK1 P28482 1/20 0.53
RAB9A P51151 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
RXFP1 Q9HBX9 1/20 0.53
SRD5A2 P31213 1/20 0.44
ATM Q13315 1/20 0.43
LSS P48449 4/20 0.43
MAOB P27338 1/20 0.42
TP53 P04637 1/20 0.40
MGLL Q99685 1/20 0.40

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
SCHEMBL2400780 0.94 ELANE (0.73) ELANEKMT2ALMNAMEN1MAPT
SCHEMBL15064112 0.86 ELANE (0.86) ELANEKMT2ALMNAMEN1MAPT
SCHEMBL449938 0.86 ELANE (0.59) ELANEKMT2ALMNAMEN1MAPT
SCHEMBL28282084 0.81 ELANE (0.54) ELANEKMT2ALMNAMEN1MAPT
Butanedione SCHEMBL28306363 0.80 ELANE (0.94) ELANEKMT2ALMNAMEN1MAPT
SCHEMBL144013 0.80 ELANE (1.00) ELANEKMT2AMEN1SRD5A2ATM
SCHEMBL2404682 0.80 ELANE (0.76) ELANEKMT2ALMNAMEN1MAPT
SCHEMBL15908309 0.80 ELANE (0.76) ELANEKMT2ALMNAMAPTSRD5A2
SCHEMBL18530461 0.80 ELANE (0.81) ELANEKMT2ASRD5A2ATM
SCHEMBL19985115 0.80 ELANE (0.76) ELANEKMT2ALMNAMAPTMAPK1

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-2013025443-A2 RADIATION CURABLE PRESSURE SENSITIVE ADHESIVE SHEET 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-02-21 WO disclosed