Nitramine

Nitramine

SCHEMBL11697129

CN(c1c([N+](=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-])[N+](=O)[O-].[Pb+4]

nearest known ligand 0.53

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.53
MEN1 O00255 2/20 0.53
HPGD P15428 2/20 0.53
NPSR1 Q6W5P4 1/20 0.53
HTT P42858 3/20 0.51
ALDH1A1 P00352 6/20 0.47
CYP3A4 P08684 1/20 0.47
GPR35 Q9HC97 4/20 0.46
TDP1 Q9NUW8 4/20 0.44
MAPT P10636 4/20 0.44
MAPK1 P28482 2/20 0.44
KDM4E B2RXH2 1/20 0.44
TTR P02766 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
ALOX15 P16050 1/20 0.44
ALOX12 P18054 1/20 0.44
RECQL P46063 1/20 0.44
PMP22 Q01453 1/20 0.44
HIF1A Q16665 1/20 0.44

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
Nitramine SCHEMBL57161 0.98 KMT2A (0.54) KMT2AMEN1HPGDNPSR1HTT
Nitramine SCHEMBL22069954 0.96 KMT2A (0.53) KMT2AMEN1HPGDNPSR1HTT
Nitramine SCHEMBL28196454 0.96 KMT2A (0.53) KMT2AMEN1HPGDNPSR1HTT
Nitramine SCHEMBL27698408 0.96 KMT2A (0.53) KMT2AMEN1HPGDNPSR1HTT
Nitramine SCHEMBL28246776 0.96 KMT2A (0.53) KMT2AMEN1HPGDNPSR1HTT
Nitramine SCHEMBL6131363 0.96 KMT2A (0.53) KMT2AMEN1HPGDNPSR1HTT
Nitramine SCHEMBL9803294 0.93 KMT2A (0.54) KMT2AMEN1HPGDNPSR1HTT
Nitramine SCHEMBL11333778 0.93 KMT2A (0.54) KMT2AMEN1HPGDNPSR1HTT
Nitramine SCHEMBL28647826 0.91 KMT2A (0.49) KMT2AMEN1HPGDNPSR1HTT
Nitramine SCHEMBL9097912 0.91 KMT2A (0.49) KMT2AMEN1HPGDNPSR1HTT

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-4015532-A Energy generator for rotating projectiles THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 1977-04-05 US disclosed