Nitric Acid

Nitric Acid

SCHEMBL1184604

Cc1ccc(NC(=N)N)cc1C.O=[N+]([O-])O

nearest known ligand 0.53

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
POLB P06746 1/20 0.49
RAB9A P51151 4/20 0.48
LMNA P02545 3/20 0.48
MAPT P10636 3/20 0.48
KDM4E B2RXH2 1/20 0.48
HTT P42858 1/20 0.48
USP2 O75604 1/20 0.47
ALOX15 P16050 1/20 0.47
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
HSD17B10 Q99714 1/20 0.47
ALDH1A1 P00352 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
ATM Q13315 1/20 0.46
TSHR P16473 1/20 0.46
RECQL P46063 1/20 0.46
F13A1 P00488 1/20 0.46
TGM2 P21980 1/20 0.46
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44

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 SCHEMBL27716562 1.00 POLB (0.49) POLBRAB9ALMNAMAPTKDM4E
SCHEMBL1186288 0.88 POLB (0.55) POLBRAB9AMAPTUSP2ALOX15
Nitric Acid SCHEMBL6034482 0.86 NPC1 (0.53) POLBRAB9ALMNAMAPTHTT
Nitric Acid SCHEMBL4166394 0.86 ALDH1A1 (0.41) POLBRAB9ALMNAMAPTKDM4E
Nitric Acid SCHEMBL3858285 0.86 KMT2A (0.58) RAB9ALMNAMAPTALDH1A1SMN1; SMN2
SCHEMBL27684440 0.83 KMT2A (0.61) RAB9ALMNAMAPTALDH1A1SMN1; SMN2
Nitric Acid SCHEMBL9982936 0.81 LMNA (0.49) POLBRAB9ALMNAMAPTKDM4E
Nitric Acid SCHEMBL1880262 0.79 CYP1A2 (0.54) RAB9ALMNAMAPTHTTHSD17B10
Nitric Acid SCHEMBL6034752 0.78 ALOX5 (0.56) POLBRAB9ALMNAMAPTKDM4E
Nitric Acid SCHEMBL1185356 0.78 ALOX5 (0.56) POLBRAB9ALMNAMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1799684-B1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS MILLENNIUM PHARM INC (US) 2014-12-03 EP disclosed
CN-102766142-A Lactam compounds useful as protein kinase inhibitors MILLENIUM PHARMACEUTICALS INC 2012-11-07 CN disclosed
CN-101068815-B Lactam compounds useful as protein kinase inhibitors MILLENNIUM PHARM INC 2012-09-05 CN disclosed
US-20120178739-A1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-07-12 US disclosed
US-7935694-B2 Lactam compounds useful as protein kinase inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-05-03 US disclosed
US-20110039820-A1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-02-17 US disclosed
US-20090105213-A1 Lactam compounds useful as protein kinase inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-04-23 US disclosed
US-7459448-B2 Lactam compounds useful as protein kinase inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-12-02 US disclosed
CN-101068815-A Lactam compounds useful as protein kinase inhibitors MILLENNIUM PHARM INC (US) 2007-11-07 CN disclosed
EP-1799684-A2 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-06-27 EP disclosed
US-20060100194-A1 Lactam compounds useful as protein kinase inhibitors MILLENNIUM PHARMACEUTICALS, INC. 2006-05-11 US disclosed
WO-2006041773-A2 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2006-04-20 WO 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 (4 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-20060100194-A1 Lactam compounds useful as protein kinase inhibitors PRKCI, PIK3CA, AKT1 POLB 2639/4885RAB9A 1640/4885LMNA 2877/4885
US-20120178739-A1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS PRKCI, PIK3CA, AKT1 POLB 2639/4885RAB9A 1640/4885LMNA 2877/4885
US-20090105213-A1 Lactam compounds useful as protein kinase inhibitors PRKCI, PIK3CA, AKT1 POLB 2639/4885RAB9A 1640/4885LMNA 2877/4885
US-20110039820-A1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS PRKCI, PIK3CA, AKT1 POLB 2639/4885RAB9A 1640/4885LMNA 2877/4885

“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.