Hydrochloric Acid

Hydrochloric Acid

SCHEMBL415484

CCCCCCCCCCCCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCCCCCCCCCCCC.CCOP(=O)(O)OCC[N+](C)(C)C.[Cl-]

nearest known ligand 0.79

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

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

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 1/20 0.79
SMN1; SMN2 Q16637 2/20 0.65
NR5A2 O00482 1/20 0.65
NR5A1 Q13285 1/20 0.65
PRKCA P17252 4/20 0.61
PRKCE Q02156 2/20 0.61
PRKCQ Q04759 2/20 0.61
PRKCD Q05655 2/20 0.61
MAPT P10636 1/20 0.57
LPAR3 Q9UBY5 7/20 0.56
LPAR1 Q92633 4/20 0.56
ENPP2 Q13822 3/20 0.56
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.52
LPAR2 Q9HBW0 2/20 0.52

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
SCHEMBL776856 0.93 FABP3 (0.72) FABP3SMN1; SMN2NR5A2NR5A1PRKCA
Phosphocholine SCHEMBL26629479 0.89 FABP3 (0.74) FABP3SMN1; SMN2NR5A2NR5A1PRKCA
Phosphocholine SCHEMBL16102973 0.89 FABP3 (0.74) FABP3SMN1; SMN2NR5A2NR5A1PRKCA
Phosphocholine SCHEMBL480378 0.89 FABP3 (0.74) FABP3SMN1; SMN2NR5A2NR5A1PRKCA
1,2-Dipalmitin SCHEMBL1833548 0.89 FABP3 (0.74) FABP3SMN1; SMN2NR5A2NR5A1PRKCA
SCHEMBL31400386 0.89 FABP3 (0.81) FABP3SMN1; SMN2NR5A2NR5A1PRKCA
SCHEMBL31106468 0.89 FABP3 (0.81) FABP3SMN1; SMN2NR5A2NR5A1PRKCA
SCHEMBL31362195 0.89 FABP3 (0.81) FABP3SMN1; SMN2NR5A2NR5A1PRKCA
SCHEMBL21680883 0.89 FABP3 (0.81) FABP3SMN1; SMN2NR5A2NR5A1PRKCA
SCHEMBL31425003 0.89 FABP3 (0.81) FABP3SMN1; SMN2NR5A2NR5A1PRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2595602-B1 SUSTAINED RELEASE siRNA FOR OCULAR DRUG DELIVERY ALLERGAN INC (US) 2018-05-23 EP claimed
US-20120022002-A1 SUSTAINED RELEASE siRNA FOR OCULAR DRUG DELIVERY ALLERGAN, INC. 2012-01-26 US claimed
EP-2595602-B1 SUSTAINED RELEASE siRNA FOR OCULAR DRUG DELIVERY ALLERGAN INC (US) 2018-05-23 EP disclosed
US-9480646-B2 Sustained release siRNA for ocular drug delivery ALLERGAN, INC. (US) 2016-11-01 US disclosed
US-20150141348-A1 SUSTAINED RELEASE siRNA FOR OCULAR DRUG DELIVERY ALLERGAN, INC. 2015-05-21 US disclosed
US-8946170-B2 Sustained release siRNA for ocular drug delivery ALLERGAN, INC. (US) 2015-02-03 US disclosed
US-20120022002-A1 SUSTAINED RELEASE siRNA FOR OCULAR DRUG DELIVERY ALLERGAN, INC. 2012-01-26 US disclosed