Palmitic Acid

Palmitic Acid

SCHEMBL28397828

CCCCCCCCCCCCCCCC(=O)O.N[C@@H]1CCCC[C@H]1N.O=C(O)C(=O)O.O=C(O)CCC(=O)O.[Pt]

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB1CDK4CDK6CHRM2CHRM3DPP4DRD2DRD3DRD4EGFRHRH1HTR1BHTR1DHTR1FHTR2AHTR2CHTR4SLC6A2SLC6A4

The experimentally established mechanism targets of Palmitic Acid. 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
GPR84 Q9NQS5 7/20 0.55
PPARG P37231 7/20 0.55
PPARD Q03181 7/20 0.55
PPARA Q07869 7/20 0.55
HDAC11 Q96DB2 5/20 0.55
TSHR P16473 4/20 0.55
PTPN1 P18031 3/20 0.55
ALDH1A1 P00352 2/20 0.55
TLR2 O60603 2/20 0.55
TDP1 Q9NUW8 2/20 0.55
FABP4 P15090 2/20 0.55
KMT2A Q03164 2/20 0.55
ALOX15 P16050 2/20 0.55
HSD17B10 Q99714 2/20 0.55
SLC22A6 Q4U2R8 1/20 0.55
SLC22A8 Q8TCC7 1/20 0.55
MEN1 O00255 1/20 0.55
ESR1 P03372 1/20 0.55
PDE4A P27815 1/20 0.55
PDE3A Q14432 1/20 0.55

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
Palmitic Acid SCHEMBL28248768 0.98 GPR84 (0.57) GPR84PPARGPPARDPPARAHDAC11
Palmitic Acid SCHEMBL17224806 0.95 GPR84 (0.53) GPR84PPARGPPARDPPARAHDAC11
Myristic Acid SCHEMBL16767554 0.93 GPR84 (0.59) GPR84PPARGPPARDPPARAHDAC11
Myristic Acid SCHEMBL29372325 0.93 GPR84 (0.59) GPR84PPARGPPARDPPARAHDAC11
Hexanoate SCHEMBL27506239 0.92 AKR1B1 (0.61) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL28352709 0.83 GPR84 (0.63) GPR84PPARGPPARDPPARAHDAC11
Dodecanoate SCHEMBL28789086 0.83 GPR84 (0.53) GPR84PPARGPPARDPPARAHDAC11
Nonanoate SCHEMBL8469400 0.81 GPR84 (0.61) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL6836285 0.81 GPR84 (0.61) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL8467872 0.81 GPR84 (0.61) GPR84PPARGPPARDPPARAHDAC11

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-106471006-B Pt (IV) derivatives and nanocarriers comprising the same 耶路撒冷希伯来大学伊森姆研究发展有限公司 2020-04-24 CN claimed