Nitric Acid

Nitric Acid

SCHEMBL11276076

Clc1ccc(CCC(CCc2ccccc2Cl)Cn2ccnc2)cc1.O=[N+]([O-])O

nearest known ligand 0.67

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
L3MBTL1 Q9Y468 2/20 0.67
LMNA P02545 4/20 0.53
TP53 P04637 4/20 0.53
CYP3A4 P08684 4/20 0.53
HIF1A Q16665 4/20 0.53
TDP1 Q9NUW8 4/20 0.53
ALDH1A1 P00352 2/20 0.53
TSHR P16473 2/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2D6 P10635 1/20 0.53
CYP2C9 P11712 1/20 0.53
ALOX15 P16050 1/20 0.53
CYP2C19 P33261 1/20 0.53
NR1I2 O75469 1/20 0.53
ESR1 P03372 1/20 0.53
NR3C1 P04150 1/20 0.53
PGR P06401 1/20 0.53
ADORA3 P0DMS8 1/20 0.53
ADRA2B P18089 1/20 0.53
CHRM3 P20309 1/20 0.53

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 SCHEMBL11276844 0.93 L3MBTL1 (0.66) L3MBTL1LMNATP53CYP3A4HIF1A
Nitric Acid SCHEMBL11275468 0.92 L3MBTL1 (0.66) L3MBTL1LMNATP53CYP3A4HIF1A
Nitric Acid SCHEMBL11303476 0.92 L3MBTL1 (0.67) L3MBTL1LMNATP53CYP3A4HIF1A
SCHEMBL11274465 0.92 CYP1A2 (0.61) L3MBTL1LMNATP53CYP3A4HIF1A
SCHEMBL11279489 0.87 CYP1A2 (0.57) L3MBTL1LMNATP53CYP3A4HIF1A
Nitric Acid SCHEMBL11284012 0.86 L3MBTL1 (0.64) L3MBTL1LMNATP53CYP3A4HIF1A
SCHEMBL11278579 0.85 CYP1A2 (0.52) L3MBTL1LMNATP53CYP3A4HIF1A
Nitric Acid SCHEMBL11275785 0.84 L3MBTL1 (0.59) L3MBTL1LMNATP53CYP3A4HIF1A
SCHEMBL11275963 0.84 CYP1A2 (0.60) L3MBTL1LMNATP53CYP3A4HIF1A
Nitric Acid SCHEMBL11283104 0.84 L3MBTL1 (0.59) L3MBTL1LMNATP53CYP3A4HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0064244-A1 Spermicidal 1-bis(arylalkyl)alkylimidazoles SYNTEX (U.S.A.) INC. (US) 1982-11-10 EP disclosed