Nitrogen

Nitrogen

SCHEMBL4074240

N#N.NN=NCc1ccccc1

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 9/20 0.42
GRIN1 Q05586 7/20 0.42
NOS2 P35228 1/20 0.42
TRPA1 O75762 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP3A4 P08684 1/20 0.41
MIF P14174 1/20 0.41
HPGD P15428 1/20 0.41
LOXL2 Q9Y4K0 2/20 0.40
GRIN2D O15399 2/20 0.38
GRIN3B O60391 2/20 0.38
GRIN2A Q12879 2/20 0.38
GRIN2C Q14957 2/20 0.38
GRIN3A Q8TCU5 2/20 0.38
SIGMAR1 Q99720 2/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA5A P35218 1/20 0.38
CA9 Q16790 1/20 0.38
HTR3A P46098 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
SCHEMBL7546087 0.95 GRIN2B (0.45) GRIN2BGRIN1NOS2TRPA1ALDH1A1
SCHEMBL3338115 0.95 GRIN2B (0.45) GRIN2BGRIN1NOS2TRPA1ALDH1A1
Alcohol SCHEMBL3173331 0.85 NOS2 (0.47) GRIN2BGRIN1NOS2TRPA1ALDH1A1
Butanedione SCHEMBL5315580 0.81 NOS2 (0.48) GRIN2BGRIN1NOS2ALDH1A1
SCHEMBL17178869 0.79 ALDH1A1 (0.52) GRIN2BGRIN1NOS2TRPA1ALDH1A1
SCHEMBL19611522 0.79 ALDH1A1 (0.52) GRIN2BGRIN1NOS2TRPA1ALDH1A1
SCHEMBL15506263 0.79 ALDH1A1 (0.52) GRIN2BGRIN1NOS2TRPA1ALDH1A1
SCHEMBL15800695 0.76 GRIN1 (0.48) GRIN2BGRIN1TRPA1ALDH1A1CYP3A4
SCHEMBL1155001 0.74
SCHEMBL18752949 0.73 HRH3 (0.48) NOS2LOXL2CA1CA2CA5A

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-3206723-A1 BIOLOGICAL INDICATOR American Sterilizer Company (US) 2017-08-23 EP claimed
WO-2016060714-A1 BIOLOGICAL INDICATOR AMERICAN STERILIZER COMPANY (US) 2016-04-21 WO claimed
EP-2084294-A2 STERILIZATION INDICATOR American Sterilizer Company (US) 2009-08-05 EP claimed
EP-2084293-A2 GENETICALLY ENGINEERED BIOLOGICAL INDICATOR American Sterilizer Company (US) 2009-08-05 EP claimed
WO-2008082728-A2 STERILIZATION INDICATOR AMERICAN STERILIZER COMPANY (US) 2008-07-10 WO claimed
WO-2008079469-A2 GENETICALLY ENGINEERED BIOLOGICAL INDICATOR AMERICAN STERILIZER COMPANY (US) 2008-07-03 WO claimed