Nitric Acid

Nitric Acid

SCHEMBL11258583

O=[N+]([O-])O.OC(Cc1ccccc1)(Cn1ccnc1)c1ccc(Br)cc1

nearest known ligand 0.48

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 19)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.48
CYP11B1 P15538 4/20 0.43
CYP11B2 P19099 4/20 0.43
CYP19A1 P11511 5/20 0.41
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 2/20 0.40
CYP2D6 P10635 2/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
TBXAS1 P24557 1/20 0.40
QPCT Q16769 1/20 0.40
CYP4Z1 Q86W10 1/20 0.40
QPCTL Q9NXS2 1/20 0.40
TP53 P04637 1/20 0.40
MDM2 Q00987 1/20 0.40
ADRA2C P18825 1/20 0.38
CYP2C9 P11712 1/20 0.38
ALOX15 P16050 1/20 0.38
CYP2C19 P33261 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 SCHEMBL11264788 0.92 HSP90AA1 (0.54) HSP90AA1CYP11B1CYP11B2CYP19A1CYP1A2
Nitric Acid SCHEMBL11265057 0.89 L3MBTL1 (0.46) HSP90AA1CYP11B1CYP11B2CYP19A1CYP3A4
Nitric Acid SCHEMBL11267648 0.89 HSP90AA1 (0.50) HSP90AA1CYP11B1CYP11B2CYP19A1CYP1A2
Nitric Acid SCHEMBL11263005 0.85 HSP90AA1 (0.53) HSP90AA1CYP11B1CYP11B2CYP19A1CYP1A2
SCHEMBL11270456 0.83 CYP11B1 (0.60) CYP11B1CYP11B2CYP19A1CYP1A2CYP3A4
Nitric Acid SCHEMBL11272681 0.83 L3MBTL1 (0.49) HSP90AA1CYP11B1CYP11B2CYP19A1CYP3A4
SCHEMBL11273426 0.80 CYP11B1 (0.50) CYP11B1CYP11B2CYP19A1CYP1A2CYP3A4
Nitric Acid SCHEMBL11270419 0.80 CYP3A4 (0.44) HSP90AA1CYP11B1CYP11B2CYP19A1CYP1A2
SCHEMBL11258585 0.80 CYP11B1 (0.42) HSP90AA1CYP11B1CYP11B2CYP19A1CYP1A2
Nitric Acid SCHEMBL11268175 0.78 HSP90AA1 (0.53) HSP90AA1CYP11B1CYP11B2CYP19A1CYP1A2

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
US-4358458-A BACTERICIDE, FUNGICIDES NORDMARK-WERKE GMBH (DE) 1982-11-09 US disclosed