Riboflavin

Riboflavin

SCHEMBL22034360

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

nearest known ligand 0.92

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Riboflavin. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 known ✓ P07550 1/20 0.78
ADRA1A known ✓ P35348 1/20 0.78
MEN1 O00255 7/20 0.92
KMT2A Q03164 7/20 0.92
USP2 O75604 4/20 0.92
KDM4E B2RXH2 4/20 0.92
HAT1 O14929 4/20 0.92
RBBP7 Q16576 4/20 0.92
HTT P42858 4/20 0.92
RECQL P46063 3/20 0.92
CASP7 P55210 3/20 0.92
MAPT P10636 3/20 0.92
CASP1 P29466 2/20 0.92
BRCA1 P38398 2/20 0.92
HSD17B10 Q99714 2/20 0.92
TST Q16762 2/20 0.92
TDP1 Q9NUW8 2/20 0.92
ALDH1A1 P00352 2/20 0.92
LMNA P02545 1/20 0.92
HBB P68871 1/20 0.92

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 SCHEMBL826819 1.00 MEN1 (0.92) MEN1KMT2AUSP2KDM4EHAT1
Riboflavin SCHEMBL50096 1.00 MEN1 (0.92) MEN1KMT2AUSP2KDM4EHAT1
Riboflavin SCHEMBL20528621 0.99 MEN1 (0.90) MEN1KMT2AUSP2KDM4EHAT1
Riboflavin SCHEMBL2241200 0.99 MEN1 (0.90) MEN1KMT2AUSP2KDM4EHAT1
Riboflavin SCHEMBL27628044 0.99 MEN1 (0.90) MEN1KMT2AUSP2KDM4EHAT1
Riboflavin SCHEMBL20474794 0.99 MEN1 (0.90) MEN1KMT2AUSP2KDM4EHAT1
Riboflavin SCHEMBL27796272 0.98 MEN1 (0.89) MEN1KMT2AUSP2KDM4EHAT1
Riboflavin SCHEMBL28875504 0.98 MEN1 (0.89) MEN1KMT2AUSP2KDM4EHAT1
Riboflavin SCHEMBL7707 0.96 MEN1 (1.00) MEN1KMT2AUSP2KDM4EHAT1
Riboflavin SCHEMBL5899262 0.96 MEN1 (1.00) MEN1KMT2AUSP2KDM4EHAT1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3914586-B1 BIS(DIAZIRINE) DERIVATIVES AS PHOTO-CROSSSLINKER FOR TREATING CORNEAL ECTATIC DISORDERS AVEDRO INC (US) 2024-03-27 EP disclosed
EP-3914586-A1 BIS(DIAZIRINE) DERIVATIVES AS PHOTO-CROSSSLINKER FOR TREATING CORNEAL ECTATIC DISORDERS Avedro Inc. (US) 2021-12-01 EP disclosed
EP-3890741-A1 COMPOUNDS AND COMPOSITIONS FOR EYE TREATMENTS Avedro Inc. (US) 2021-10-13 EP disclosed
WO-2020154673-A1 BIS(DIAZIRINE) DERIVATIVES AS PHOTO-CROSSSLINKER FOR TREATING CORNEAL ECTATIC DISORDERS AVEDRO, INC. (US) 2020-07-30 WO disclosed
WO-2020117974-A1 COMPOUNDS AND COMPOSITIONS FOR EYE TREATMENTS AVEDRO, INC. (US) 2020-06-11 WO disclosed