Phosphoric Acid

Phosphoric Acid

SCHEMBL6509596

CCCCOc1ccc(-c2ccc(CCC(N)(CO)CO)cc2F)cc1.O=P(O)(O)O

nearest known ligand 0.74

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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 4)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 20/20 0.74
S1PR3 Q99500 10/20 0.74
S1PR4 O95977 1/20 0.47
S1PR5 Q9H228 1/20 0.47

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
SCHEMBL6505995 0.91 S1PR1 (0.89) S1PR1S1PR3S1PR4S1PR5
SCHEMBL6529053 0.88 S1PR1 (0.78) S1PR1S1PR3S1PR4S1PR5
Hydrochloric Acid SCHEMBL6527438 0.87 S1PR1 (0.76) S1PR1S1PR3S1PR4S1PR5
SCHEMBL6529498 0.85 S1PR1 (1.00) S1PR1S1PR3S1PR4S1PR5
SCHEMBL13628896 0.79 S1PR1 (0.69) S1PR1S1PR3S1PR4S1PR5
SCHEMBL9399589 0.78 RARB (0.55) S1PR1S1PR3
SCHEMBL6528028 0.78 S1PR1 (0.61) S1PR1S1PR3S1PR4S1PR5
Hydrochloric Acid SCHEMBL6501505 0.77 S1PR1 (0.60) S1PR1S1PR3S1PR4S1PR5
SCHEMBL6508458 0.77 S1PR1 (0.59) S1PR1S1PR3S1PR4S1PR5
SCHEMBL15581265 0.76 S1PR1 (0.48) S1PR1S1PR3

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
WO-2005014525-A2 BI-ARYL COMPOUND HAVING IMMUNOSUPPRESSIVE ACTIVITY MITSUBISHI PHARMA CORPORATION (JP) 2005-02-17 WO disclosed