Palmitaldehyde

Palmitaldehyde

SCHEMBL27557698

CCCCCCCCCCCCCCCC=O.CCO.[HH].[HH]

nearest known ligand 0.80

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Known targets — ChEMBL curated mechanism

MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Palmitaldehyde. 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 2/20 0.80
FAAH O00519 3/20 0.70
TRPV1 Q8NER1 2/20 0.70
TERT O14746 3/20 0.48
PTPN1 P18031 3/20 0.48
PPARG P37231 3/20 0.48
PPARD Q03181 3/20 0.48
PPARA Q07869 3/20 0.48
TOP1 P11387 3/20 0.48
MAPT P10636 2/20 0.48
BLM P54132 2/20 0.48
HSD17B10 Q99714 2/20 0.48
FABP4 P15090 2/20 0.48
GMNN O75496 1/20 0.48
USP2 O75604 1/20 0.48
LMNA P02545 1/20 0.48
CYP1A2 P05177 1/20 0.48
POLB P06746 1/20 0.48
CYP2C9 P11712 1/20 0.48
ALOX15 P16050 1/20 0.48

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
Decanal SCHEMBL28505277 0.97 TSHR (0.84) TSHRFAAHTRPV1HSD17B10LMNA
Tridecanal SCHEMBL29019017 0.97 TSHR (0.84) TSHRFAAHTRPV1HSD17B10LMNA
Nonanal SCHEMBL2352897 0.97 TSHR (0.84) TSHRFAAHTRPV1HSD17B10LMNA
Octanal SCHEMBL8439593 0.97 TSHR (0.84) TSHRFAAHTRPV1HSD17B10LMNA
Hexanal SCHEMBL28119013 0.95 TSHR (0.79) TSHRFAAHTRPV1MAPTBLM
Octanal SCHEMBL2453523 0.90 TSHR (0.80) TSHRFAAHTRPV1HSD17B10LMNA
Tridecanal SCHEMBL9083185 0.90 TSHR (0.80) TSHRFAAHTRPV1HSD17B10LMNA
Palmitaldehyde SCHEMBL6162415 0.90 TSHR (0.80) TSHRFAAHTRPV1HSD17B10LMNA
Heptanal SCHEMBL2454694 0.90 TSHR (0.80) TSHRFAAHTRPV1HSD17B10LMNA
Octanal SCHEMBL27493183 0.90 TSHR (0.89) TSHRFAAHTRPV1MAPTBLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1385457-A Gel composition PANRICO PARTNERSHIP INC (US) 2002-12-18 CN disclosed
CN-1348815-A Medicine for preventing and treating coronary heart disease and angina pectoris and its prepn and other use TIANJIN TIANSHILI PHARMACEUTIC (CN) 2002-05-15 CN disclosed