Nitric Acid

Nitric Acid

SCHEMBL3221126

Cc1ccc(Br)cc1N=C(N)N.O=[N+]([O-])O

nearest known ligand 0.41

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 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 5/20 0.41
SIGMAR1 Q99720 3/20 0.39
ALDH1A1 P00352 3/20 0.39
MPO P05164 2/20 0.38
SLC22A2 O15244 1/20 0.38
SLC22A1 O15245 1/20 0.38
SLC22A3 O75751 1/20 0.38
PLG P00747 1/20 0.37
PLAT P00750 1/20 0.37
MAPT P10636 2/20 0.35
GRIN2D O15399 1/20 0.35
GRIN3B O60391 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
GRIN2B Q13224 1/20 0.35
GRIN2C Q14957 1/20 0.35
GRIN3A Q8TCU5 1/20 0.35
CYP3A4 P08684 2/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
Nitric Acid SCHEMBL7811356 0.81 ALDH1A1 (0.60) PLAUSIGMAR1ALDH1A1MPOSLC22A2
Nitric Acid SCHEMBL1718 0.81 ALDH1A1 (0.53) PLAUSIGMAR1ALDH1A1MAPTGRIN2D
SCHEMBL2694958 0.78 ALDH1A1 (0.55) PLAUSIGMAR1ALDH1A1MAPTGRIN2D
Nitric Acid SCHEMBL1587377 0.77 PLAU (0.59) PLAUSIGMAR1ALDH1A1GRIN2DGRIN3B
Nitric Acid SCHEMBL1587382 0.77 PLAU (0.59) PLAUSIGMAR1ALDH1A1GRIN2DGRIN3B
Hydrochloric Acid SCHEMBL14763718 0.76 ALDH1A1 (0.54) PLAUSIGMAR1ALDH1A1MAPTGRIN2D
SCHEMBL9316468 0.74 SIGMAR1 (0.63) PLAUSIGMAR1MPOSLC22A2SLC22A1
SCHEMBL11876737 0.74 PLAU (0.60) PLAUSIGMAR1ALDH1A1SLC22A2SLC22A1
Nitric Acid SCHEMBL1833741 0.73 PLAU (0.73) PLAUSIGMAR1SLC22A2SLC22A1SLC22A3
Sulfuric Acid SCHEMBL21799347 0.73 ALDH1A1 (0.51) PLAUSIGMAR1ALDH1A1MAPTGRIN2D

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-2010014022-A1 A PROCESS FOR THE PREPARATION OF IMATINIB TEMAPHARM SP. Z O.O. (PL) 2010-02-04 WO disclosed