Paeoniflorin

Paeoniflorin

SCHEMBL17880403

CC12CC3(O)OC(O1)[C@]1(COC(=O)c4ccccc4)[C@@H]3CC21O[C@@H]1OC(CO)[C@@H](O)C(O)[C@@H]1O

nearest known ligand 0.88

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC22A1 O15245 1/20 0.88
GRK2 P25098 1/20 0.80
SYNJ2 O15056 3/20 0.49
MAOB P27338 1/20 0.39
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
HSP90AA1 P07900 1/20 0.34
PTPN1 P18031 1/20 0.33
LGALS9 O00182 1/20 0.33
LGALS1 P09382 1/20 0.33
LGALS3 P17931 1/20 0.33
LGALS7; LGALS7B P47929 1/20 0.33
SELP P16109 1/20 0.33

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
Paeoniflorin SCHEMBL15236857 1.00 SLC22A1 (0.88) SLC22A1GRK2SYNJ2MAOBALDH1A1
Paeoniflorin SCHEMBL13615628 1.00 SLC22A1 (0.88) SLC22A1GRK2SYNJ2MAOBALDH1A1
Paeoniflorin SCHEMBL20009472 1.00 SLC22A1 (0.88) SLC22A1GRK2SYNJ2MAOBALDH1A1
Paeoniflorin SCHEMBL24935593 1.00 SLC22A1 (0.88) SLC22A1GRK2SYNJ2MAOBALDH1A1
Paeoniflorin SCHEMBL14088840 1.00 SLC22A1 (0.88) SLC22A1GRK2SYNJ2MAOBALDH1A1
Paeoniflorin SCHEMBL24927267 1.00 SLC22A1 (0.88) SLC22A1GRK2SYNJ2MAOBALDH1A1
Paeoniflorin SCHEMBL549033 1.00 SLC22A1 (0.88) SLC22A1GRK2SYNJ2MAOBALDH1A1
Paeoniflorin SCHEMBL29396890 1.00 SLC22A1 (0.88) SLC22A1GRK2SYNJ2MAOBALDH1A1
Paeoniflorin SCHEMBL22649040 1.00 SLC22A1 (0.88) SLC22A1GRK2SYNJ2MAOBALDH1A1
Paeoniflorin SCHEMBL7625329 0.99 SLC22A1 (0.87) SLC22A1GRK2SYNJ2MAOBALDH1A1

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
US-20160184298-A1 INHIBITORS AND ENHANCERS OF URIDINE DIPHOSPHATE-GLUCURONOSYLTRANSFERASE 2B (UGT2B) NAT DEFENSE MEDICAL CT (TW) 2016-06-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160184298-A1 INHIBITORS AND ENHANCERS OF URIDINE DIPHOSPHATE-GLUCURONOSYLTRANSFERASE 2B (UGT2B) UGT2B7, UGT2B17, UGT1A10 SLC22A1 175/4885GRK2 951/4885SYNJ2 1660/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.