Nitric Acid

Nitric Acid

SCHEMBL5354098

COc1ccc(NC(=N)N)cc1.O=[N+]([O-])O

nearest known ligand 0.52

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
ALDH1A1 P00352 4/20 0.52
MAPT P10636 4/20 0.52
NPC1 O15118 4/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
RAB9A P51151 3/20 0.51
ALOX5 P09917 1/20 0.50
GAA P10253 1/20 0.49
HPGD P15428 1/20 0.49
HTT P42858 1/20 0.49
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
TP53 P04637 1/20 0.47
ALOX15 P16050 1/20 0.47
LMNA P02545 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
HSP90AA1 P07900 1/20 0.46
PKM P14618 1/20 0.46
PAX8 Q06710 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TGM2 P21980 1/20 0.45

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
SCHEMBL1186050 0.88 NPC1 (0.59) MAPTNPC1SMN1; SMN2RAB9AGAA
Hydrochloric Acid SCHEMBL3977693 0.86 NPC1 (0.57) MAPTNPC1SMN1; SMN2RAB9AGAA
Bicarbonate SCHEMBL3975933 0.85 RAB9A (0.61) ALDH1A1MAPTNPC1SMN1; SMN2RAB9A
Nitric Acid SCHEMBL1183979 0.84 PLAU (0.49) ALDH1A1MAPTNPC1SMN1; SMN2RAB9A
Nitric Acid SCHEMBL1363033 0.82 PLAU (0.54) ALDH1A1MAPTNPC1SMN1; SMN2RAB9A
Nitric Acid SCHEMBL9982936 0.81 LMNA (0.49) ALDH1A1MAPTNPC1SMN1; SMN2RAB9A
Nitric Acid SCHEMBL1185356 0.81 ALOX5 (0.56) ALDH1A1MAPTNPC1SMN1; SMN2RAB9A
Nitric Acid SCHEMBL6034752 0.81 ALOX5 (0.56) ALDH1A1MAPTNPC1SMN1; SMN2RAB9A
Nitric Acid SCHEMBL2073717 0.80 KMT2A (0.50) ALDH1A1MAPTSMN1; SMN2RAB9AHPGD
Nitric Acid SCHEMBL27720595 0.80 IDO1 (0.60) ALDH1A1MAPTNPC1SMN1; SMN2RAB9A

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
US-7160897-B2 Therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2007-01-09 US disclosed
US-7087618-B2 Pyrazolopyridinyl pyrimidine therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2006-08-08 US disclosed
US-20050182080-A1 Therapeutic compounds CHAMBERLAIN STANLEY D (US) 2005-08-18 US disclosed
EP-1341788-B1 PYRAZOLOPYRIDINES GLAXO GROUP LTD (GB) 2005-08-10 EP disclosed
US-20050171133-A1 Therapeutic compounds CHAMBERLAIN STANLEY D (US) 2005-08-04 US disclosed
US-6919352-B2 Pyrazolopyridinyl pyridine and pyrimidine therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2005-07-19 US disclosed
US-20040072853-A1 Therapeutic compounds CHAMBERLAIN STANLEY D (US) 2004-04-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040072853-A1 Therapeutic compounds PCSK9, ABCB1, FURIN ALDH1A1 168/4885MAPT 797/4885NPC1 21/4885
US-20050182080-A1 Therapeutic compounds PCSK9, FURIN, CYP11B2 ALDH1A1 207/4885MAPT 815/4885NPC1 27/4885
US-20050171133-A1 Therapeutic compounds PCSK9, FURIN, CYP11B2 ALDH1A1 207/4885MAPT 815/4885NPC1 27/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.