Sugi Predict

Sugi Predict / Compounds / Riboflavin

Riboflavin

Riboflavin

SCHEMBL27764352

CC(C)C(=O)O.Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)CO)c2cc1C

nearest known ligand 0.89

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 0.89
▸ KMT2A Q03164 7/20 0.89
▸ USP2 O75604 4/20 0.89
▸ HAT1 O14929 4/20 0.89
▸ RBBP7 Q16576 4/20 0.89
▸ HTT P42858 4/20 0.89
▸ KDM4E B2RXH2 3/20 0.89
▸ RECQL P46063 3/20 0.89
▸ CASP7 P55210 3/20 0.89
▸ MAPT P10636 3/20 0.89
▸ CASP1 P29466 2/20 0.89
▸ BRCA1 P38398 2/20 0.89
▸ HSD17B10 Q99714 2/20 0.89
▸ TST Q16762 2/20 0.89
▸ TDP1 Q9NUW8 2/20 0.89
▸ LMNA P02545 1/20 0.89
▸ HBB P68871 1/20 0.89
▸ ALDH1A1 P00352 1/20 0.89
▸ CYP1A2 P05177 1/20 0.89
▸ CYP3A4 P08684 1/20 0.89

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
Riboflavin SCHEMBL2345412 0.96 MEN1 (0.89) MEN1KMT2AUSP2HAT1RBBP7
Riboflavin SCHEMBL7135127 0.94 MEN1 (0.92) MEN1KMT2AUSP2HAT1RBBP7
Riboflavin SCHEMBL2798981 0.94 MEN1 (0.92) MEN1KMT2AUSP2HAT1RBBP7
Riboflavin SCHEMBL2127865 0.94 MEN1 (0.92) MEN1KMT2AUSP2HAT1RBBP7
Riboflavin SCHEMBL2799507 0.94 MEN1 (0.92) MEN1KMT2AUSP2HAT1RBBP7
Riboflavin SCHEMBL2420598 0.94 MEN1 (1.00) MEN1KMT2AUSP2HAT1RBBP7
Riboflavin SCHEMBL7706 0.94 MEN1 (1.00) MEN1KMT2AUSP2HAT1RBBP7
Riboflavin SCHEMBL9609755 0.94 MEN1 (1.00) MEN1KMT2AUSP2HAT1RBBP7
Riboflavin SCHEMBL5899262 0.94 MEN1 (1.00) MEN1KMT2AUSP2HAT1RBBP7
Riboflavin SCHEMBL7707 0.94 MEN1 (1.00) MEN1KMT2AUSP2HAT1RBBP7

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
CN-101584699-A Application of lactoflavin ester derivative for preparing medicine for treating diabetes mellitus and complication thereof FUGUI CUI (CN) 2009-11-25 — — CN disclosed
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