SCHEMBL7926028

SCHEMBL7926028

O=[PH](O)C(O)c1ccccc1.[Ca+2].[H+]

nearest known ligand 0.43

Known targets — ChEMBL curated mechanism

GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.43
MAPK1 P28482 1/20 0.43
SRC P12931 2/20 0.39
CYP2D6 P10635 1/20 0.39
CES2 O00748 2/20 0.39
CES1 P23141 2/20 0.39
TSHR P16473 1/20 0.37
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL8858822 0.98 LMNA (0.44) LMNAMAPK1SRCCYP2D6CES2
SCHEMBL9540931 0.98 LMNA (0.44) LMNAMAPK1SRCCYP2D6CES2
SCHEMBL10765606 0.95 LMNA (0.43) LMNAMAPK1SRCCYP2D6CES2
Ammonia Solution, Strong SCHEMBL9515772 0.95 LMNA (0.43) LMNAMAPK1SRCCYP2D6CES2
SCHEMBL9544281 0.95 LMNA (0.43) LMNAMAPK1SRCCYP2D6CES2
SCHEMBL5200301 0.95 LMNA (0.43) LMNAMAPK1SRCCYP2D6CES2
Potassium Ion SCHEMBL9296986 0.95 LMNA (0.43) LMNAMAPK1SRCCYP2D6CES2
Water SCHEMBL21046213 0.95 LMNA (0.43) LMNAMAPK1SRCCYP2D6CES2
Ammonia Solution, Strong SCHEMBL21495185 0.95 LMNA (0.43) LMNAMAPK1SRCCYP2D6CES2
Zinc Ion SCHEMBL7745848 0.95 LMNA (0.43) LMNAMAPK1SRCCYP2D6CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6258795-B1 Acylated uridine and cytidine and uses thereof PRO-NEURON, INC. 2001-07-10 US disclosed
US-5470838-A Method of delivering exogenous uridine or cytidine using acylated uridine or cytidine PRO-NEURON, INC. (US) 1995-11-28 US disclosed
EP-0407543-A4 MAMMALIAN GAP-43 COMPOSITIONS AND METHODS OF USE 1992-10-14 EP disclosed
EP-0445229-A4 ADHESION OF MYCOPLASMA PNEUMONIAE AND MYCOPLASMA HOMINUS TO SULFATIDE US HEALTH (US) 1991-12-27 EP disclosed
EP-0407543-A1 MAMMALIAN GAP-43 COMPOSITIONS AND METHODS OF USE THE GENERAL HOSPITAL CORPORATION (US) 1991-01-16 EP disclosed
EP-0339075-A4 ACYLATED URIDINE AND CYTIDINE AND USES THEREOF. PRO NEURON INC (US) 1990-04-10 EP disclosed
EP-0339075-A1 ACYLATED URIDINE AND CYTIDINE AND USES THEREOF PRO-NEURON, INC. (US) 1989-11-02 EP disclosed
WO-1989003837-A1 ACYLATED URIDINE AND CYTIDINE AND USES THEREOF PRO-NEURON, INC. (US) 1989-05-05 WO disclosed
EP-0308452-A1 AN ORAL COMPOSITION CONTAINING PARTICLES COMPRISING AN ACTIVE SUBSTANCE BENZON PHARMA A/S (DK) 1989-03-29 EP disclosed
WO-1988006893-A1 AN ORAL COMPOSITION CONTAINING PARTICLES COMPRISING AN ACTIVE SUBSTANCE BENZON PHARMA A/S (DK) 1988-09-22 WO disclosed