Hydrogen Sulfide

Hydrogen Sulfide

SCHEMBL28200717

NNc1cc(F)ccc1F.S

nearest known ligand 0.42

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 4/20 0.41
CA9 Q16790 2/20 0.41
CA3 P07451 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
PKM P14618 2/20 0.38
HTT P42858 2/20 0.38
POLB P06746 1/20 0.38
DHFR P00374 1/20 0.37
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
KDM1A O60341 2/20 0.36

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
SCHEMBL124354 0.98 ALDH1A1 (0.42) MAPTSMN1; SMN2ALDH1A1CA9CA3
SCHEMBL29544738 0.98 ALDH1A1 (0.42) MAPTSMN1; SMN2ALDH1A1CA9CA3
Hydrochloric Acid SCHEMBL29502148 0.95 MAPT (0.41) MAPTSMN1; SMN2ALDH1A1CA9CA3
Bromide SCHEMBL20984147 0.95 MAPT (0.41) MAPTSMN1; SMN2ALDH1A1CA9CA3
Hydrochloric Acid SCHEMBL1408624 0.95 MAPT (0.41) MAPTSMN1; SMN2ALDH1A1CA9CA3
Phosphine SCHEMBL28200789 0.95 MAPT (0.41) MAPTSMN1; SMN2ALDH1A1CA9CA3
Oxalic Acid SCHEMBL20984172 0.86 MAPT (0.46) MAPTSMN1; SMN2ALDH1A1CA9CA3
Sulfuric Acid SCHEMBL20984178 0.86 CA9 (0.44) MAPTSMN1; SMN2ALDH1A1CA9CA3
Phosphoric Acid SCHEMBL20984126 0.86 MAPT (0.43) MAPTSMN1; SMN2ALDH1A1CA9CA3
Nitric Acid SCHEMBL20984812 0.82 ATM (0.43) MAPTSMN1; SMN2ALDH1A1CA9CA3

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-107663161-A A kind of continuous stream synthesis technique of phenylhydrazine salt and substituted benzene hydrazonium salt 上海惠和化德生物科技有限公司 2018-02-06 CN disclosed