Hydrogen Sulfide

Hydrogen Sulfide

SCHEMBL28429267

CNCCCC(=O)O.S.[NaH].[NaH]

nearest known ligand 0.48

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4A O75164 1/20 0.48
KDM4C Q9H3R0 1/20 0.48
LMNA P02545 2/20 0.48
SLC22A6 Q4U2R8 2/20 0.48
TSHR P16473 6/20 0.46
NFKB1 P19838 1/20 0.46
PMP22 Q01453 1/20 0.46
ADRA1A P35348 1/20 0.45
AKR1B1 P15121 1/20 0.44
PRMT1 Q99873 1/20 0.43
PPARG P37231 6/20 0.42
PPARD Q03181 6/20 0.42
PPARA Q07869 6/20 0.42
GPR84 Q9NQS5 5/20 0.42
HDAC11 Q96DB2 5/20 0.42
ALDH1A1 P00352 2/20 0.42
TLR2 O60603 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
FABP4 P15090 2/20 0.42
PTPN1 P18031 2/20 0.42

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
SCHEMBL27610031 0.97
SCHEMBL288681 0.95
SCHEMBL580257 0.92
Hydrochloric Acid SCHEMBL380897 0.92
SCHEMBL9343010 0.92 LMNA (0.50) KDM4AKDM4CLMNASLC22A6TSHR
SCHEMBL693740 0.87
SCHEMBL8389930 0.85 KDM4A (0.63) KDM4AKDM4CLMNASLC22A6TSHR
SCHEMBL6047707 0.85 KDM4A (0.63) KDM4AKDM4CLMNASLC22A6TSHR
SCHEMBL5050892 0.85 KDM4A (0.63) KDM4AKDM4CLMNASLC22A6TSHR
SCHEMBL8039895 0.85 KDM4A (0.63) KDM4AKDM4CLMNASLC22A6TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111302993-B Preparation method of 4-phenylmercaptothiophenol 新发药业有限公司 2022-10-21 CN disclosed
CN-111302993-A Preparation method of 4-phenylmercaptothiophenol 新发药业有限公司 2020-06-19 CN disclosed