Phosphoric Acid

Phosphoric Acid

SCHEMBL2936593

CCCCCCCCC=CCCCCCCCC(=O)C(O)C(=O)CO.O=P(O)(O)O

nearest known ligand 0.54

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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
KCNH2 known ✓ Q12809 1/20 0.51
FABP3 P05413 5/20 0.54
TERT O14746 3/20 0.51
PTPN1 P18031 3/20 0.51
PPARG P37231 3/20 0.51
PPARD Q03181 3/20 0.51
PPARA Q07869 3/20 0.51
CYP1A2 P05177 2/20 0.51
MAPT P10636 2/20 0.51
CYP2C19 P33261 2/20 0.51
BLM P54132 2/20 0.51
HSD17B10 Q99714 2/20 0.51
FABP4 P15090 2/20 0.51
FAAH O00519 2/20 0.51
KMT2A Q03164 2/20 0.51
GMNN O75496 1/20 0.51
USP2 O75604 1/20 0.51
LMNA P02545 1/20 0.51
POLB P06746 1/20 0.51
CYP2C9 P11712 1/20 0.51

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
SCHEMBL15365009 0.95 TERT (0.56) FABP3TERTPTPN1PPARGPPARD
SCHEMBL15365007 0.95 TERT (0.56) FABP3TERTPTPN1PPARGPPARD
Phosphoric Acid SCHEMBL2926558 0.91 CES2 (0.50) FAAHKMT2AMEN1LPAR1
Phosphoric Acid SCHEMBL2935023 0.91 CES2 (0.50) FAAHKMT2AMEN1LPAR1
SCHEMBL28770638 0.89 TERT (0.63) FABP3TERTPTPN1PPARGPPARD
SCHEMBL2139859 0.85 CES2 (0.55) PPARGPPARDPPARAFAAHKMT2A
SCHEMBL5582211 0.85 CES2 (0.55) PPARGPPARDPPARAFAAHKMT2A
Phosphoric Acid SCHEMBL28539599 0.82 FABP3 (0.51) FABP3TERTPTPN1PPARGPPARD
Phosphoric Acid SCHEMBL1690026 0.81 FABP3 (0.50) FABP3TERTCYP1A2MAPTCYP2C19
SCHEMBL2936590 0.80 PLA2G4A (0.49) FABP3LPAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150168419-A1 PREDICTION OF A SMALL-FOR-GESTATIONAL AGE (SGA) INFANT UNIVERSITY COLLEGE CORK - NATIONAL UNIVERSITY OF IRELAND, CORK (IE) 2015-06-18 US claimed
US-20130295679-A1 PREDICTION OF A SMALL-FOR-GESTATIONAL AGE (SGA) INFANT UNIVERSITY COLLEGE CORK - NATIONAL UNIVERSITY OF IRELAND, CORK (IE) 2013-11-07 US claimed
EP-2641092-A1 PREDICTION OF A SMALL-FOR-GESTATIONAL AGE (SGA) INFANT University College Cork - National University of Ireland, Cork (IE) 2013-09-25 EP claimed
WO-2012066057-A1 PREDICTION OF A SMALL-FOR-GESTATIONAL AGE (SGA) INFANT UNIVERSITY COLLEGE CORK - NATIONAL UNIVERSITY OF IRELAND, CORK (IE) 2012-05-24 WO claimed
US-20150168419-A1 PREDICTION OF A SMALL-FOR-GESTATIONAL AGE (SGA) INFANT UNIVERSITY COLLEGE CORK - NATIONAL UNIVERSITY OF IRELAND, CORK (IE) 2015-06-18 US disclosed
US-20130295679-A1 PREDICTION OF A SMALL-FOR-GESTATIONAL AGE (SGA) INFANT UNIVERSITY COLLEGE CORK - NATIONAL UNIVERSITY OF IRELAND, CORK (IE) 2013-11-07 US disclosed
EP-2641092-A1 PREDICTION OF A SMALL-FOR-GESTATIONAL AGE (SGA) INFANT University College Cork - National University of Ireland, Cork (IE) 2013-09-25 EP disclosed
WO-2012066057-A1 PREDICTION OF A SMALL-FOR-GESTATIONAL AGE (SGA) INFANT UNIVERSITY COLLEGE CORK - NATIONAL UNIVERSITY OF IRELAND, CORK (IE) 2012-05-24 WO disclosed
EP-2230312-A1 Probe compound for detecting and isolating enzymes and means and methods using the same Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2010-09-22 EP disclosed