Gabosin D

Gabosin D

SCHEMBL30250105

CC(=O)OCC1=C[C@@H](O)[C@@H](O)[C@H](O)C1=O

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GSTP1 P09211 9/20 0.51
GSTA2 P09210 6/20 0.39
ALDH1A1 P00352 2/20 0.37
GSTM1 P09488 4/20 0.35
PTPN1 P18031 1/20 0.33
NLRP3 Q96P20 1/20 0.31
CYP3A4 P08684 1/20 0.30

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
SCHEMBL11777188 0.80 GSTP1 (0.48) GSTP1
SCHEMBL3341999 0.80 GSTP1 (0.48) GSTP1
SCHEMBL11780701 0.72 AHCY (0.36)
SCHEMBL16431077 0.72 AHCY (0.36)
SCHEMBL31606946 0.72 AHCY (0.36)
SCHEMBL23544215 0.64 ALDH1A1 (0.38) GSTP1GSTA2ALDH1A1GSTM1PTPN1
SCHEMBL16432103 0.64 FUCA1 (0.32)
SCHEMBL1141683 0.62 ALDH1A1 (0.47) GSTP1ALDH1A1PTPN1NLRP3CYP3A4
SCHEMBL4359905 0.61
SCHEMBL26147089 0.61 ALDH1A1 (0.38) GSTP1ALDH1A1PTPN1NLRP3CYP3A4

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-115678786-B Dandelion endophytic fungi and application thereof 扬州大学 2024-02-23 CN disclosed
CN-115678786-A Dandelion endophytic fungus and application thereof 扬州大学 2023-02-03 CN disclosed