Geraniol

Geraniol

SCHEMBL9769106

CC(=O)O.CC(=O)O.CC(=O)O.CC(C)=CCC/C(C)=C/CO

nearest known ligand 0.83

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.83
ALOX15 P16050 3/20 0.83
MEN1 O00255 3/20 0.83
CYP3A4 P08684 2/20 0.83
MAPT P10636 3/20 0.79
ALDH1A1 P00352 3/20 0.79
UGT1A1 P22309 1/20 0.79
KDM4E B2RXH2 1/20 0.61
ATM Q13315 1/20 0.61
FNTA P49354 2/20 0.58
FNTB P49356 2/20 0.58
SQLE Q14534 5/20 0.57
POLB P06746 1/20 0.53
TRPA1 O75762 1/20 0.53

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
Geraniol SCHEMBL20481434 1.00 KMT2A (0.83) KMT2AALOX15MEN1CYP3A4MAPT
Nerol SCHEMBL28146868 1.00 KMT2A (0.83) KMT2AALOX15MEN1CYP3A4MAPT
Geraniol SCHEMBL57142 1.00 KMT2A (0.83) KMT2AALOX15MEN1CYP3A4MAPT
Geraniol SCHEMBL3664268 1.00 KMT2A (0.83) KMT2AALOX15MEN1CYP3A4MAPT
Farnesol SCHEMBL509427 0.98 KMT2A (0.83) KMT2AALOX15MEN1CYP3A4MAPT
Farnesol SCHEMBL29087994 0.98 KMT2A (0.83) KMT2AALOX15MEN1CYP3A4MAPT
Geranylgeraniol SCHEMBL1573864 0.98 KMT2A (0.83) KMT2AALOX15MEN1CYP3A4MAPT
Nerol SCHEMBL28538301 0.96 KMT2A (0.83) KMT2AALOX15MEN1CYP3A4MAPT
Geraniol SCHEMBL27824090 0.96 KMT2A (0.83) KMT2AALOX15MEN1CYP3A4MAPT
Geraniol SCHEMBL5576765 0.93 KMT2A (0.86) KMT2AALOX15MEN1CYP3A4MAPT

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
US-5011688-A Analgesic, antihistamine, diuretic and flavorings CALAM AND ASSOCIATES, INC. 1991-04-30 US disclosed