Nitrous Acid

Nitrous Acid

SCHEMBL28022168

CN(C)/C=C/c1ccncc1C(=O)O.O=NO

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 14/20 0.39
▸ HTT P42858 1/20 0.39
▸ KDM6B O15054 7/20 0.38
▸ KDM4D Q6B0I6 3/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ KDM4A O75164 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ SIRT3 Q9NTG7 1/20 0.34
▸ CCNC P24863 2/20 0.33
▸ CDK8 P49336 2/20 0.33
▸ LATS1 O95835 1/20 0.31
▸ RECQL P46063 1/20 0.31

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
SCHEMBL31165744 0.82 KDM4C (0.46) KDM4CHTTKDM6BKDM4DTDP1
SCHEMBL28022167 0.82 HTT (0.38) HTTTDP1KDM4EALDH1A1MAPT
SCHEMBL22589227 0.73 HPGD (0.34) HTTKDM4EALDH1A1MAPTRECQL
SCHEMBL22589228 0.73 HPGD (0.34) HTTKDM4EALDH1A1MAPTRECQL
SCHEMBL9000661 0.72 KDM4C (0.44) KDM4CKDM6BKDM4DTDP1KDM4E
SCHEMBL29956489 0.71 KDM4C (0.50) KDM4CKDM6BKDM4DTDP1KDM4E
SCHEMBL10526340 0.71 KDM4C (0.50) KDM4CKDM6BKDM4DTDP1KDM4E
SCHEMBL27185866 0.71 CYP11B1 (0.50) KDM4CKDM6BKDM4DTDP1KDM4E
SCHEMBL29856256 0.68 CCNC (0.51) HTTTDP1KDM4EMEN1ALDH1A1
SCHEMBL4049897 0.68 PTPN1 (0.42) KDM4CKDM6BKDM4DTDP1KDM4E

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
CN-104736543-A 7-azaindol-2,7-naphthyridine derivative for the treatment of tumors MERCK PATENT GMBH 2015-06-24 — — CN disclosed
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