Nitrous Acid

Nitrous Acid

SCHEMBL1979274

O=C1NC(=S)NC1c1ccccc1.O=NO

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
DHFR P00374 1/20 0.46
GUSB P08236 1/20 0.45
CA2 P00918 3/20 0.42
CA1 P00915 2/20 0.42
MAPT P10636 2/20 0.41
TOP2A P11388 1/20 0.40
SLC22A12 Q96S37 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HPGD P15428 2/20 0.39
RXFP1 Q9HBX9 1/20 0.39
USP2 O75604 1/20 0.39
POLB P06746 1/20 0.39
CA12 O43570 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
LMNA P02545 2/20 0.38
ADORA3 P0DMS8 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
SCHEMBL62941 0.91 ALDH1A1 (0.58) ALDH1A1MEN1KMT2ADHFRGUSB
Nitrous Acid SCHEMBL7062049 0.83 TDP1 (0.56) ALDH1A1CA2MAPTHPGDUSP2
Alanine SCHEMBL891875 0.80 ALDH1A1 (0.48) ALDH1A1MEN1KMT2ADHFRGUSB
SCHEMBL27404601 0.78 ALDH1A1 (0.44) ALDH1A1MEN1KMT2ADHFRGUSB
Threonine SCHEMBL7805410 0.76 ALDH1A1 (0.43) ALDH1A1MEN1KMT2ADHFRGUSB
SCHEMBL9701173 0.75 DHFR (0.62) ALDH1A1DHFRGUSBMAPTPOLB
Nitrous Acid SCHEMBL7059824 0.74 DDB1 (0.38) MEN1KMT2AGUSBPOLBLMNA
SCHEMBL9864478 0.74 ALDH1A1 (0.63) ALDH1A1MEN1KMT2ADHFRGUSB
SCHEMBL1421442 0.74 TDP1 (0.68) ALDH1A1MEN1KMT2ACA2CA1
Norleucine SCHEMBL7458269 0.72 DHFR (0.46) ALDH1A1MEN1KMT2ADHFRGUSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0549752-B1 PROTEIN SEQUENCING BECKMAN COULTER INC (US) 1999-03-17 EP claimed
EP-0444441-B1 Minimizing eluate band widths in liquid chromatography HEWLETT PACKARD CO (US) 1996-09-25 EP claimed
EP-2336783-A1 C-terminal sequencing of amino acids BASF SE (DE) 2011-06-22 EP disclosed
WO-2003031983-A2 METHOD FOR DETECTING AMINO ACIDS CONSEQUENCE GMBH (DE) 2003-04-17 WO disclosed
WO-2003031984-A2 METHOD FOR ANALYSING THE SEQUENCE OF POLYPEPTIDES CONSEQUENCE GMBH (DE) 2003-04-17 WO disclosed