Tarenninoside D

Tarenninoside D

SCHEMBL29426111

COc1cc(/C=C/C(=O)OC[C@H]2O[C@@H](O[C@@H]3OC=C(C(=O)O)[C@H]4CC=C(C(=O)O)[C@@H]34)[C@H](O)[C@@H](O)[C@@H]2O)ccc1O

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRKCA P17252 3/20 0.46
▸ CYP19A1 P11511 1/20 0.46
▸ PTPN1 P18031 1/20 0.43
▸ MMP2 P08253 1/20 0.43
▸ MMP3 P08254 1/20 0.43
▸ MMP9 P14780 1/20 0.43
▸ MMP12 P39900 1/20 0.43
▸ MMP13 P45452 1/20 0.43
▸ MAOB P27338 1/20 0.42
▸ ELANE P08246 1/20 0.42
▸ LDHA P00338 1/20 0.42
▸ CA12 O43570 1/20 0.42
▸ CA4 P22748 1/20 0.42
▸ CA6 P23280 1/20 0.42
▸ CA5A P35218 1/20 0.42
▸ CA7 P43166 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ CA14 Q9ULX7 1/20 0.42
▸ CA5B Q9Y2D0 1/20 0.42
▸ AMY2A P04746 1/20 0.41

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
Tarenninoside F SCHEMBL29426269 0.87 PRKCA (0.51) PRKCACYP19A1PTPN1ELANESNCA
Tarenninoside E SCHEMBL29426088 0.86 PTPN1 (0.46) PRKCACYP19A1PTPN1ELANE
Tarenninoside C SCHEMBL29426155 0.86 XDH (0.52) PTPN1
SCHEMBL29426143 0.85 PRKCA (0.52) PRKCACYP19A1PTPN1MMP2MMP3
SCHEMBL29425919 0.81 PTPN1 (0.52) PTPN1ELANECA12CA4CA7
Tarenninoside A SCHEMBL29426059 0.80 XDH (0.51) PTPN1
SCHEMBL29425865 0.78 PTPN1 (0.49) PRKCACYP19A1PTPN1ELANECA12
SCHEMBL3366430 0.78 MAOB (0.60) PRKCACYP19A1MMP9MMP13MAOB
SCHEMBL29425833 0.77 PRKCA (0.51) PRKCACYP19A1MMP2MMP3MMP9
SCHEMBL24140171 0.76 MAOB (0.61) PRKCACYP19A1MMP9MMP13MAOB

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
EP-3409766-B1 AN ESTERASE THAT IS CAPABLE OF CONVERTING IRIDOIDS AND SECO-IRIDOIDS N ZYME BIOTEC GMBH (DE) 2022-03-09 — — EP disclosed
Send feedback