Nitric Acid

Nitric Acid

SCHEMBL1644176

Cc1ccc([N+](=O)[O-])cc1NN=C(N)N.O=[N+]([O-])O

nearest known ligand 0.52

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 9/20 0.52
▸ LMNA P02545 2/20 0.51
▸ HTT P42858 2/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ KAT2B Q92831 1/20 0.49
▸ TSHR P16473 2/20 0.47
▸ CYP3A4 P08684 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ GRIN2D O15399 2/20 0.47
▸ GRIN3B O60391 2/20 0.47
▸ GRIN1 Q05586 2/20 0.47
▸ GRIN2A Q12879 2/20 0.47
▸ GRIN2B Q13224 2/20 0.47
▸ GRIN2C Q14957 2/20 0.47
▸ GRIN3A Q8TCU5 2/20 0.47
▸ SIGMAR1 Q99720 2/20 0.47
▸ KMT2A Q03164 4/20 0.47
▸ POLB P06746 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ HPGD P15428 2/20 0.46

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 SCHEMBL30496141 0.78 HTT (0.57) ALDH1A1LMNAHTTSMN1; SMN2KAT2B
Nitric Acid SCHEMBL1717 0.78 HTT (0.57) ALDH1A1LMNAHTTSMN1; SMN2KAT2B
Nitric Acid SCHEMBL1644459 0.77 KMT2A (0.42) ALDH1A1LMNAHTTSMN1; SMN2TDP1
SCHEMBL5527561 0.76 HTT (0.65) ALDH1A1LMNAHTTSMN1; SMN2CYP3A4
SCHEMBL2819067 0.75 ALDH1A1 (0.60) ALDH1A1LMNAHTTSMN1; SMN2KAT2B
SCHEMBL31284756 0.75 LMNA (0.61) ALDH1A1LMNAHTTSMN1; SMN2KAT2B
SCHEMBL11775750 0.75 LMNA (0.61) ALDH1A1LMNAHTTSMN1; SMN2KAT2B
SCHEMBL1583292 0.75 HTT (0.59) ALDH1A1LMNAHTTSMN1; SMN2KAT2B
SCHEMBL14314822 0.75 HTT (0.59) ALDH1A1LMNAHTTSMN1; SMN2KAT2B
SCHEMBL31436924 0.75 ALDH1A1 (0.65) ALDH1A1LMNAHTTSMN1; SMN2KAT2B

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
US-8466154-B2 Methods and compositions related to wrapping of dehydrons THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2013-06-18 — — US disclosed
US-20130131076-A1 METHODS AND COMPOSITIONS RELATED TO WRAPPING OF DEHYDRONS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2013-05-23 — — US disclosed
US-20110097268-A1 RADIOHALOIMATINIBS AND METHODS OF THEIR SYNTHESIS AND USE IN PET IMAGING OF CANCERS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2011-04-28 — — US disclosed
WO-2008070350-A9 METHODS AND COMPOSITIONS RELATED TO WRAPPING OF DEHYDRONS UNIV TEXAS (US) 2008-10-23 — — WO disclosed
WO-2008070350-A2 METHODS AND COMPOSITIONS RELATED TO WRAPPING OF DEHYDRONS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2008-06-12 — — WO disclosed
WO-2008024829-A2 RADIOHALOIMATINIBS AND METHODS OF THEIR SYNTHESIS AND USE IN PET IMAGING OF CANCERS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2008-02-28 — — 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-20130131076-A1 METHODS AND COMPOSITIONS RELATED TO WRAPPING OF DEHYDRONS DKK1, HPN, OSBP2 ALDH1A1 3889/4885LMNA 3233/4885HTT 4052/4885
US-20110097268-A1 RADIOHALOIMATINIBS AND METHODS OF THEIR SYNTHESIS AND USE IN PET IMAGING OF CANCERS ROS1, HRAS, MYC ALDH1A1 2834/4885LMNA 4606/4885HTT 1453/4885

“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.

Send feedback