Nitric Acid

Nitric Acid

SCHEMBL6034669

NC(N)=Nc1ccc(OCCO)cc1.O=[N+]([O-])O

nearest known ligand 0.63

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
FURIN P09958 2/20 0.63
ADRA2A P08913 3/20 0.53
PLAU P00749 1/20 0.50
PRSS1 P07477 3/20 0.49
ACR P10323 1/20 0.49
ADRA2B P18089 1/20 0.47
ADRA2C P18825 1/20 0.47
HGFAC Q04756 3/20 0.47
HTR3E A5X5Y0 1/20 0.45
HTR3B O95264 1/20 0.45
HTR3A P46098 1/20 0.45
HTR3D Q70Z44 1/20 0.45
HTR3C Q8WXA8 1/20 0.45
F2 P00734 2/20 0.43
PRSS2 P07478 2/20 0.43
PRSS3 P35030 2/20 0.43
POLB P06746 1/20 0.42
ALDH1A1 P00352 1/20 0.41
RECQL P46063 1/20 0.41
ASAH1 Q13510 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 SCHEMBL7232751 0.83 FURIN (0.56) FURINADRA2APLAUPRSS1ACR
Nitric Acid SCHEMBL6033851 0.83 FURIN (0.56) FURINADRA2APLAUPRSS1ACR
Nitric Acid SCHEMBL6034084 0.83 FURIN (0.52) FURINADRA2APLAUPRSS1ACR
Nitric Acid SCHEMBL6033181 0.76 PLAU (0.54) ADRA2APLAUPRSS1ADRA2BADRA2C
Nitric Acid SCHEMBL6033724 0.76 SMN1; SMN2 (0.53) FURINADRA2AALDH1A1
Nitric Acid SCHEMBL6033962 0.76 FURIN (0.48) FURINADRA2APLAUPRSS1ACR
Nitric Acid SCHEMBL6034196 0.76 TBXAS1 (0.60) ALDH1A1
SCHEMBL27663831 0.74 FURIN (0.76) FURINADRA2APLAUPRSS1ACR
Nitric Acid SCHEMBL6033973 0.74 MAPT (0.47) PRSS1POLBALDH1A1RECQLGAA
Nitric Acid SCHEMBL7240334 0.73 HTR3E (0.44) FURINPLAUPRSS1ACRHTR3E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1187816-B1 5-CYANO-2-AMINOPYRIMIDINE DERIVATIVES CELLTECH R&D LTD (GB) 2006-12-20 EP disclosed
US-20040180914-A1 5-Cyano-2-aminopyrimidine derivatives CELLTECH R&D LIMTIED 2004-09-16 US disclosed
US-6579983-B1 Potent and selective inhibitors of receptor tyrosine kinases involved in angiogenesis, especially KDR kinase and/or FGFr kinase CELLTECH R&D LIMITED (GB) 2003-06-17 US disclosed
US-20020147339-A1 5-cyano-2-aminopyrimidine derivatives CELLTECH R&D LIMITED (GB) 2002-10-10 US disclosed
EP-1187816-A1 5-CYANO-2-AMINOPYRIMIDINE DERIVATIVES Celltech R&D Limited (GB) 2002-03-20 EP disclosed
WO-2000078731-A1 5-CYANO-2-AMINOPYRIMIDINE DERIVATIVES CELLTECH R&D LIMITED (GB) 2000-12-28 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 (2 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-20040180914-A1 5-Cyano-2-aminopyrimidine derivatives FLT1, FGFR1, KDR FURIN 4722/4885ADRA2A 794/4885PLAU 3039/4885
US-20020147339-A1 5-cyano-2-aminopyrimidine derivatives FLT1, FGFR1, KDR FURIN 4740/4885ADRA2A 680/4885PLAU 3100/4885

“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.