Nitric Acid

Nitric Acid

SCHEMBL6033904

N=C(N)Nc1ccc(-n2ccnn2)cc1.O=[N+]([O-])O

nearest known ligand 0.44

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
NOTUM Q6P988 6/20 0.44
MAPK10 P53779 2/20 0.42
MAPK9 P45984 1/20 0.42
F10 P00742 1/20 0.38
CYP19A1 P11511 1/20 0.37
MAPK8 P45983 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
KDM4E B2RXH2 2/20 0.35
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
TYK2 P29597 1/20 0.35
JAK3 P52333 1/20 0.35
KCNH2 Q12809 1/20 0.35
RAB9A P51151 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KEAP1 Q14145 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
SCHEMBL17844194 0.79 NOTUM (0.51) NOTUMMAPK10MAPK9F10CYP19A1
Nitric Acid SCHEMBL6033192 0.78 MAPT (0.47) NOTUMF10HTTRAB9AMEN1
Nitric Acid SCHEMBL6033909 0.78 PLAU (0.46) NOTUMMAPK10MAPK9CYP19A1
Nitric Acid SCHEMBL6033797 0.77 FBP1 (0.49) MAPK10RXFP1KDM4ERAB9AKMT2A
Nitric Acid SCHEMBL6033955 0.76 TBXAS1 (0.45) CYP19A1MEN1KMT2AALDH1A1
SCHEMBL9109445 0.74 NOTUM (0.58) NOTUMMAPK10MAPK9F10CYP19A1
Nitric Acid SCHEMBL2852035 0.74 PEPD (0.52) F10KDM4EL3MBTL1MEN1KMT2A
Nitric Acid SCHEMBL9982936 0.72 LMNA (0.49) KDM4EHTTRAB9AMEN1KMT2A
Nitric Acid SCHEMBL3860512 0.72 KMT2A (0.59) F10RAB9AMEN1KMT2ASMN1; SMN2
Nitric Acid SCHEMBL1833737 0.72 MEN1 (0.46) F10RAB9AMEN1KMT2ASMN1; SMN2

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 NOTUM 4600/4885MAPK10 1627/4885MAPK9 1119/4885
US-20020147339-A1 5-cyano-2-aminopyrimidine derivatives FLT1, FGFR1, KDR NOTUM 4625/4885MAPK10 1613/4885MAPK9 1225/4885

“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.