Strictosidine

Strictosidine

SCHEMBL8322946

C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1C[C@@H]1NCCc2c1[nH]c1ccccc21

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HTR1A P08908 2/20 0.56
▸ ACHE P22303 1/20 0.52
▸ POLB P06746 1/20 0.44
▸ CTDSP1 Q9GZU7 1/20 0.44
▸ STAT3 P40763 12/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ PTPN1 P18031 1/20 0.40

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
Strictosidine SCHEMBL29456822 1.00 HTR1A (0.56) HTR1AACHEPOLBCTDSP1STAT3
Strictosidine SCHEMBL29456742 1.00 HTR1A (0.56) HTR1AACHEPOLBCTDSP1STAT3
Strictosidinic Acid SCHEMBL4729136 0.92 HTR1A (0.48) HTR1AACHEPOLBCTDSP1STAT3
SCHEMBL22919319 0.90 HTR1A (0.47) HTR1AACHEMEN1KMT2A
SCHEMBL19353678 0.84 CYP2D6 (0.44) MEN1KMT2A
SCHEMBL4097773 0.80 DRD2 (0.48) POLBCTDSP1STAT3MEN1MAPT
SCHEMBL3205755 0.80 DRD2 (0.48) POLBCTDSP1STAT3MEN1MAPT
SCHEMBL2978568 0.79 HTR1A (0.72) HTR1ASTAT3MAPT
Secologanin SCHEMBL22658018 0.77 HTR1A (0.68) HTR1AACHESTAT3MEN1MAPT
SCHEMBL30004407 0.77 HTR1A (0.46) HTR1AACHEPOLBCTDSP1STAT3

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
US-20210024944-A1 METHOD OF PRODUCING ALKALOID AJINOMOTO CO., INC. (JP) 2021-01-28 — — US disclosed
WO-2004113336-A1 CARBOLINE AND BETACARBOLINE DERIVATIVES FOR USE AS HDAC ENZYME INHIBITORS CHROMA THERAPEUTICS LIMITED (GB) 2004-12-29 — — WO disclosed
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