Nitric Acid

Nitric Acid

SCHEMBL7811356

Cc1ccc(Cl)cc1N=C(N)N.O=[N+]([O-])O

nearest known ligand 0.60

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 2/20 0.60
PLAU P00749 4/20 0.41
NPFFR1 Q9GZQ6 1/20 0.41
NPFFR2 Q9Y5X5 1/20 0.41
HTR3E A5X5Y0 5/20 0.39
HTR3B O95264 5/20 0.39
HTR3A P46098 5/20 0.39
HTR3D Q70Z44 5/20 0.39
HTR3C Q8WXA8 5/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MPO P05164 2/20 0.38
SLC22A2 O15244 2/20 0.38
SLC22A1 O15245 2/20 0.38
SLC22A3 O75751 2/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CYP3A4 P08684 1/20 0.38

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 SCHEMBL7813154 0.84 HTR3E (0.46) ALDH1A1PLAUHTR3EHTR3BHTR3A
Nitric Acid SCHEMBL3221126 0.81 PLAU (0.41) ALDH1A1PLAULMNASMN1; SMN2MPO
Nitric Acid SCHEMBL1718 0.81 ALDH1A1 (0.53) ALDH1A1PLAULMNAPOLBSMN1; SMN2
Nitric Acid SCHEMBL7804174 0.81 HTR3E (0.63) ALDH1A1PLAUHTR3EHTR3BHTR3A
SCHEMBL2694958 0.78 ALDH1A1 (0.55) ALDH1A1PLAULMNAPOLBSMN1; SMN2
Nitric Acid SCHEMBL1587377 0.77 PLAU (0.59) ALDH1A1PLAUHTR3EHTR3BHTR3A
Nitric Acid SCHEMBL1587382 0.77 PLAU (0.59) ALDH1A1PLAUHTR3EHTR3BHTR3A
Hydrochloric Acid SCHEMBL14763718 0.76 ALDH1A1 (0.54) ALDH1A1PLAULMNAPOLBSMN1; SMN2
SCHEMBL11346799 0.75 ALDH1A1 (0.56) ALDH1A1NPFFR1NPFFR2HTR3EHTR3B
SCHEMBL10592734 0.74 ALDH1A1 (0.54) ALDH1A1PLAUNPFFR1NPFFR2HTR3E

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-0672041-B1 PHARMACOLOGICALLY ACTIVE PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF NOVARTIS AG (CH) 2001-11-14 EP disclosed
CN-1047776-C Pharmacologically active pyridine derivatives and processes for the preparation thereof NOVARTIS AG (CH) 1999-12-29 CN disclosed
US-5728708-A ANTITUMOR AGENTS NOVARTIS CORPORATION (US) 1998-03-17 US disclosed
CN-1115982-A pyridine derivatives having pharmacological activity and preparation method thereof CIBA GEIGY AG (CH) 1996-01-31 CN disclosed
EP-0672041-A1 PHARMACOLOGICALLY ACTIVE PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF Novartis AG (CH) 1995-09-20 EP disclosed
WO-1995009853-A1 PHARMACOLOGICALLY ACTIVE PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF CIBA-GEIGY AG (CH) 1995-04-13 WO disclosed