Nitric Acid

Nitric Acid

SCHEMBL325044

CCOCC(CC)(CC)OCC.O=[N+]([O-])O.O=[N+]([O-])O

nearest known ligand 0.31

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ERG11

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

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CA5A P35218 1/20 0.31
CA5B Q9Y2D0 1/20 0.31

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
SCHEMBL217249 0.83
Ether SCHEMBL502338 0.73
SCHEMBL28411593 0.69 ALDH1A1 (0.48)
Nitric Acid SCHEMBL7083184 0.69 ALDH1A1 (0.48) CA5ACA5B
Nitric Acid SCHEMBL7206652 0.69 ALDH1A1 (0.48) CA5ACA5B
SCHEMBL3289528 0.66 TSHR (0.35)
SCHEMBL28460627 0.65 ALDH1A1 (0.48)
Nitric Acid SCHEMBL8210908 0.65 CA5A (0.35) CA5ACA5B
SCHEMBL21847348 0.65 TSHR (0.31)
2-Ethoxyethanol SCHEMBL10613720 0.64 ALDH1A1 (0.67) CA5ACA5B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120167451-A1 PYROLYSIS OIL BASED FUEL AND METHOD OF PRODUCTION NEW GENERATION BIOFUELS HOLDINGS, INC. (US) 2012-07-05 US disclosed
WO-2012006316-A1 PYROLYSIS OIL BASED FUEL AND METHOD OF PRODUCTION NEW GENERATION BIOFUELS HOLDINGS, INC. (US) 2012-01-12 WO disclosed