Nitric Acid

Nitric Acid

SCHEMBL2910175

COc1ccc(N=C(N)N)cc1F.O=[N+]([O-])O

nearest known ligand 0.61

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
HTR3E A5X5Y0 3/20 0.61
HTR3B O95264 3/20 0.61
HTR3A P46098 3/20 0.61
HTR3D Q70Z44 3/20 0.61
HTR3C Q8WXA8 3/20 0.61
PLAU P00749 3/20 0.45
LMNA P02545 1/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 1/20 0.43
PRSS1 P07477 2/20 0.43
ACR P10323 2/20 0.43
TAAR1 Q96RJ0 1/20 0.42
GRIN2D O15399 2/20 0.41
GRIN3B O60391 2/20 0.41
GRIN1 Q05586 2/20 0.41
GRIN2A Q12879 2/20 0.41
GRIN2B Q13224 2/20 0.41
GRIN2C Q14957 2/20 0.41
GRIN3A Q8TCU5 2/20 0.41

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 SCHEMBL6955447 0.89 HTR3E (0.77) HTR3EHTR3BHTR3AHTR3DHTR3C
Nitric Acid SCHEMBL6034777 0.81 PLAU (0.53) HTR3EHTR3BHTR3AHTR3DHTR3C
Nitric Acid SCHEMBL11561556 0.80 PLAU (0.49) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL5243029 0.77 HTR3E (1.00) HTR3EHTR3BHTR3AHTR3DHTR3C
Nitric Acid SCHEMBL6980748 0.77 HTR3E (0.53) HTR3EHTR3BHTR3AHTR3DHTR3C
Nitric Acid SCHEMBL6034257 0.76 ITGB3 (0.60) HTR3EHTR3BHTR3AHTR3DHTR3C
Nitric Acid SCHEMBL3859434 0.76 PLAU (0.51) HTR3EHTR3BHTR3AHTR3DHTR3C
Nitric Acid SCHEMBL2913167 0.75 HTR3E (0.79) HTR3EHTR3BHTR3AHTR3DHTR3C
Nitric Acid SCHEMBL20984181 0.75 HTT (0.44) LMNAMAPK1HTTRAB9ATDP1
Nitric Acid SCHEMBL6033747 0.74 PLAU (0.47) HTR3EHTR3BHTR3AHTR3DHTR3C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2222682-A1 IMIDAZO-THIAZOLE DERIVATIVES AS PROTEIN KINASE INHIBITORS Abbott Laboratories (US) 2010-09-01 EP disclosed
WO-2009070516-A1 IMIDAZO-THIAZOLE DERIVATIVES AS PROTEIN KINASE INHIBITORS ABBOTT LABORATORIES (US) 2009-06-04 WO disclosed