Phosphoric Acid Monododecyl Ester

Phosphoric Acid Monododecyl Ester

SCHEMBL28863149

CCCCCCCCCCCCOP(=O)(O)O.O=S(=O)(O)O.[KH].[KH].[NaH]

nearest known ligand 0.78

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3CALCRLCHRM1CHRM2CHRM3F2RMAOAMAOBMAP2K1MAP2K2NTRK1NTRK2NTRK3OPRD1OPRK1OPRM1P2RY12PKLRSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASLC18A2SLC6A2SLC6A3TLR7TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8dacAdacBdacCfolAftsImrcAmrcBmrdApolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmB1rpmB2rpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmHrpmIrpmJrpmJ2rpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsR1rpsR2rpsSrpsTrpsUrpsZykgMykgO

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

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 14/20 0.78
LPAR2 Q9HBW0 11/20 0.78
LPAR1 Q92633 8/20 0.78
LPAR5 Q9H1C0 1/20 0.50
ENPP2 Q13822 1/20 0.42

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
Phosphoric Acid Monododecyl Ester SCHEMBL28243095 1.00 LPAR3 (0.78) LPAR3LPAR2LPAR1LPAR5ENPP2
Phosphoric Acid Monododecyl Ester SCHEMBL27494134 0.98 LPAR3 (0.81) LPAR3LPAR2LPAR1LPAR5
Phosphoric Acid Monododecyl Ester SCHEMBL27464086 0.98 LPAR3 (0.81) LPAR3LPAR2LPAR1LPAR5
Phosphoric Acid Monododecyl Ester SCHEMBL28288417 0.98 LPAR3 (0.81) LPAR3LPAR2LPAR1LPAR5
Phosphoric Acid Monododecyl Ester SCHEMBL27534734 0.96 LPAR3 (0.78) LPAR3LPAR2LPAR1LPAR5ENPP2
Phosphoric Acid Monododecyl Ester SCHEMBL21824296 0.96 LPAR3 (0.84) LPAR3LPAR2LPAR1LPAR5
Phosphoric Acid Monododecyl Ester SCHEMBL28078217 0.90 LPAR3 (0.88) LPAR3LPAR2LPAR1LPAR5
SCHEMBL28337300 0.90 LPAR3 (0.95) LPAR3LPAR2LPAR1LPAR5
SCHEMBL3411900 0.90 LPAR3 (0.95) LPAR3LPAR2LPAR1LPAR5
Hexadecyl Dihydrogen Phosphate SCHEMBL61625 0.90 LPAR3 (0.95) LPAR3LPAR2LPAR1LPAR5

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-108431118-A Latex composition 日本瑞翁株式会社 2018-08-21 CN disclosed