Nitric Acid

Nitric Acid

SCHEMBL4476163

N=C(N)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1.O=[N+]([O-])O

nearest known ligand 0.48

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 16)

geneUniProtsupporting neighboursconfidence
P2RX1 P51575 8/20 0.48
MAPT P10636 2/20 0.46
TMPRSS4 Q9NRS4 1/20 0.46
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA9 Q16790 2/20 0.44
GPR35 Q9HC97 1/20 0.44
LMNA P02545 1/20 0.43
ACP1 P24666 1/20 0.42
IKBKE Q14164 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
P2RX4 Q99571 1/20 0.40
P2RX7 Q99572 1/20 0.40

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 SCHEMBL4467533 0.90 ACP1 (0.48) P2RX1MAPTTMPRSS4CA12CA1
Nitric Acid SCHEMBL1673 0.90 P2RX1 (0.51) P2RX1MAPTTMPRSS4CA12CA1
Nitric Acid SCHEMBL4474668 0.89 ATF1 (0.46) P2RX1MAPTTMPRSS4CA12CA1
SCHEMBL11884384 0.88 MAPT (0.52) P2RX1MAPTCA12CA1CA2
Nitric Acid SCHEMBL4476359 0.86 TMPRSS4 (0.46) P2RX1MAPTTMPRSS4LMNANPSR1
Nitric Acid SCHEMBL4479271 0.85 ALDH1A1 (0.55) MAPTCA12CA1CA2CA9
Nitric Acid SCHEMBL2856189 0.84 KIF11 (0.53) MAPTCA12CA1CA2CA9
Nitric Acid SCHEMBL5732960 0.80 ALDH1A1 (0.49) MAPTLMNARAB9ANPSR1
SCHEMBL5567788 0.78 GPR35 (0.43) P2RX1MAPTTMPRSS4CA12CA1
Nitric Acid SCHEMBL4467527 0.78 SOS1 (0.34) P2RX1MAPTLMNARAB9AP2RX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582630-B2 Pyradazine compounds as GSK-3 inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2009-09-01 US disclosed
US-20060069097-A1 Pyradazine compounds as gsk-3 inhibitors SMITHKLINE BEECHAM CORPORATION 2006-03-30 US disclosed
EP-1551842-A1 PYRADAZINE COMPOUNDS AS GSK-3 INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2005-07-13 EP disclosed
WO-2004035588-A1 PYRADAZINE COMPOUNDS AS GSK-3 INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2004-04-29 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 (1 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-20060069097-A1 Pyradazine compounds as gsk-3 inhibitors GSK3B, GSK3A, GSKIP P2RX1 2462/4885MAPT 461/4885TMPRSS4 3498/4885

“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.