Sugi Predict

Sugi Predict / Compounds / Hydrogen Sulfide

Hydrogen Sulfide

Hydrogen Sulfide

SCHEMBL25316691

CC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O.S

nearest known ligand 0.90

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NAA50 Q9GZZ1 2/20 0.89
▸ CHAT P28329 2/20 0.83
▸ EP300 Q09472 4/20 0.82
▸ KAT5 Q92993 2/20 0.82
▸ AURKA O14965 2/20 0.82
▸ KAT2B Q92831 1/20 0.82
▸ CREBBP Q92793 1/20 0.74

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
SCHEMBL27888712 0.99 NAA50 (0.90) NAA50CHATEP300KAT5AURKA
SCHEMBL13461662 0.99 NAA50 (0.90) NAA50CHATEP300KAT5AURKA
SCHEMBL28164093 0.99 NAA50 (0.90) NAA50CHATEP300KAT5AURKA
SCHEMBL24800603 0.99 NAA50 (0.90) NAA50CHATEP300KAT5AURKA
SCHEMBL60436 0.99 NAA50 (0.90) NAA50CHATEP300KAT5AURKA
SCHEMBL4368632 0.99 NAA50 (0.90) NAA50CHATEP300KAT5AURKA
SCHEMBL31690470 0.99 NAA50 (0.89) NAA50CHATEP300KAT5AURKA
Acetone SCHEMBL27777287 0.99 NAA50 (0.89) NAA50CHATEP300KAT5AURKA
Acetic Acid SCHEMBL29287784 0.98 NAA50 (0.88) NAA50CHATEP300KAT5AURKA
Acetic Acid SCHEMBL31361751 0.98 NAA50 (0.88) NAA50CHATEP300KAT5AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023134446-A1 VALENCENE SYNTHASE MUTANT AND VALENCENE HIGH-YIELD STRAIN 武汉合生科技有限公司 2023-07-20 — — WO claimed
CN-109996865-A It is dehydrated to form alkene by the enzymatic of alkanol 布拉斯肯有限公司 2019-07-09 — — CN disclosed
CN-109880782-A Synthesis gas or other gaseous carbon sources and methanol are converted into the method and organism of 1,3 butylene glycol 基因组股份公司 2019-06-14 — — CN disclosed
CN-109312373-A For producing microorganism and the method for ethylene glycol and C3compounds altogether 布拉斯肯有限公司 2019-02-05 — — CN disclosed
CN-109136161-A Synthesis gas or other gaseous carbon sources and methanol are converted into the method and organism of 1,3 butylene glycol 基因组股份公司 2019-01-04 — — CN disclosed
CN-106795529-A Use the method for the synthetically prepared alkane of microbial association KOLBE 赢创德固赛有限公司 2017-05-31 — — CN disclosed