Nitrous Acid

Nitrous Acid

SCHEMBL28845232

COc1cc(C(=O)O)cc(Cl)n1.O=NO

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 2/20 0.50
TAS1R3 Q7RTX0 1/20 0.47
TAS1R1 Q7RTX1 1/20 0.47
TAS1R2 Q8TE23 1/20 0.47
LMNA P02545 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
TPMT P51580 2/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA3 P07451 1/20 0.40
PKM P14618 1/20 0.40
CA4 P22748 1/20 0.40
CA6 P23280 1/20 0.40
CA5A P35218 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40
CA5B Q9Y2D0 1/20 0.40

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
SCHEMBL837798 0.93 ALDH1A1 (0.56) ALDH1A1KDM4ETAS1R3TAS1R1TAS1R2
SCHEMBL11342868 0.84 ALDH1A1 (0.47) ALDH1A1KDM4ETAS1R3TAS1R1TAS1R2
2,6-Dichloroisonicotinic Acid SCHEMBL28513386 0.82 TPMT (0.48) ALDH1A1KDM4ELMNATDP1TPMT
SCHEMBL668838 0.82 KDM4E (0.69) ALDH1A1KDM4ELMNATDP1TPMT
SCHEMBL931870 0.80 ALDH1A1 (0.52) ALDH1A1KDM4ETAS1R3TAS1R1TAS1R2
SCHEMBL5761347 0.80 ALDH1A1 (0.52) ALDH1A1KDM4ETAS1R3TAS1R1TAS1R2
SCHEMBL28845230 0.79 ALDH1A1 (0.53) ALDH1A1KDM4ETAS1R3TAS1R1TAS1R2
SCHEMBL13570729 0.78 ALDH1A1 (0.50) ALDH1A1KDM4ETAS1R3TAS1R1TAS1R2
SCHEMBL31287794 0.78 ALDH1A1 (0.76) ALDH1A1KDM4ETAS1R3TAS1R1TAS1R2
SCHEMBL567975 0.78 ALDH1A1 (0.76) ALDH1A1KDM4ETAS1R3TAS1R1TAS1R2

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-115066438-A ASGPR binding compounds for degrading extracellular proteins 阿维拉治疗公司 2022-09-16 CN disclosed