Phosphoric Acid

Phosphoric Acid

SCHEMBL5501341

Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1I.O=P(O)(O)O

nearest known ligand 0.69

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Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Phosphoric 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
LMNA P02545 3/20 0.57
MTOR P42345 2/20 0.57
ALDH1A1 P00352 2/20 0.57
THRB P10828 1/20 0.57
MDM2 Q00987 1/20 0.57
NCOA1 Q15788 1/20 0.57
NCOA3 Q9Y6Q9 1/20 0.57
GMNN O75496 1/20 0.57
TP53 P04637 1/20 0.57
NFKB1 P19838 1/20 0.57
DNMT1 P26358 1/20 0.57
THPO P40225 1/20 0.57
HTT P42858 1/20 0.57
RAB9A P51151 1/20 0.57
BLM P54132 1/20 0.57
HBB P68871 1/20 0.57
PMP22 Q01453 1/20 0.57
PYGM P11217 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.48
POLB P06746 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
Phosphoric Acid SCHEMBL20240168 1.00 LMNA (0.57) LMNAMTORALDH1A1THRBMDM2
SCHEMBL19657184 0.95 LMNA (0.62) LMNAMTORALDH1A1THRBMDM2
SCHEMBL2583859 0.95 LMNA (0.62) LMNAMTORALDH1A1THRBMDM2
SCHEMBL12937913 0.95 LMNA (0.62) LMNAMTORALDH1A1THRBMDM2
SCHEMBL770112 0.95 LMNA (0.62) LMNAMTORALDH1A1THRBMDM2
SCHEMBL6297249 0.95 LMNA (0.62) LMNAMTORALDH1A1THRBMDM2
SCHEMBL770113 0.95 LMNA (0.62) LMNAMTORALDH1A1THRBMDM2
SCHEMBL12230437 0.95 LMNA (0.62) LMNAMTORALDH1A1THRBMDM2
SCHEMBL27936168 0.87 LMNA (0.58) LMNAMTORALDH1A1THRBMDM2
Phosphoric Acid SCHEMBL14661092 0.86 LMNA (0.57) LMNAMTORALDH1A1THRBMDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0828750-B1 PALLADIUM CATALYZED NUCLEOSIDE MODIFICATION METHODS USING NUCLEOPHILES AND CARBON MONOXIDE EC TECHNOLOGY LLC (US) 2013-07-17 EP disclosed
EP-0828750-A4 PALLADIUM CATALYZED NUCLEOSIDE MODIFICATION METHODS USING NUCLEOPHILES AND CARBON MONOXIDE EC TECHNOLOGY LLC (US) 2007-11-07 EP disclosed
US-5945527-A REACTING CYTOSINE CONTAINING A LEAVING GROUP ATTACHED TO 5- OR 6-POSTION OF MOLECULE, ISOLATING MODIFIED NUCLEOSIDE; FOR NOVEL FUNGICIDES, VIRICIDES, BACTERICIDES, ANTITUMOR AGENTS NEXSTAR PHARMACEUTICALS, INC. (US) 1999-08-31 US disclosed
EP-0828750-A1 PALLADIUM CATALYZED NUCLEOSIDE MODIFICATION METHODS USING NUCLEOPHILES AND CARBON MONOXIDE NeXstar Pharmaceuticals, Inc. (US) 1998-03-18 EP disclosed
WO-1996038460-A1 PALLADIUM CATALYZED NUCLEOSIDE MODIFICATION METHODS USING NUCLEOPHILES AND CARBON MONOXIDE NEXSTAR PHARMACEUTICALS, INC. (US) 1996-12-05 WO disclosed