Pyrogallol Red

Pyrogallol Red

SCHEMBL29441973

O=c1ccc2c(-c3ccccc3S(=O)(=O)O)c3ccc(O)c(O)c3oc-2c1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 2/20 1.00
KDM4A O75164 1/20 1.00
USP2 O75604 1/20 1.00
NSD2 O96028 1/20 1.00
ALPL P05186 1/20 1.00
PLCG1 P19174 1/20 1.00
TNNI3 P19429 1/20 1.00
TNNT2 P45379 1/20 1.00
MMP14 P50281 1/20 1.00
CASP6 P55212 1/20 1.00
TNNC1 P63316 1/20 1.00
KDM4C Q9H3R0 1/20 1.00
L3MBTL1 Q9Y468 1/20 1.00
GNG2 P59768 7/20 0.66
GNB1 P62873 7/20 0.66
HPGD P15428 7/20 0.50
ALOX15 P16050 7/20 0.50
HSD17B10 Q99714 7/20 0.50
HSPA1A P0DMV8 4/20 0.50
HSPA8 P11142 4/20 0.50

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
Pyrogallol Red SCHEMBL3398009 1.00 NFKB1 (1.00) NFKB1KDM4AUSP2NSD2ALPL
SCHEMBL13320794 0.81 GNG2 (0.69) NFKB1KDM4AUSP2NSD2ALPL
SCHEMBL13352283 0.80 GNG2 (0.71) NFKB1KDM4AUSP2NSD2ALPL
SCHEMBL2777300 0.80 GNG2 (1.00) NFKB1KDM4AUSP2NSD2ALPL
SCHEMBL2848097 0.79 GNG2 (0.80) NFKB1KDM4AUSP2NSD2ALPL
SCHEMBL13891771 0.75 GNG2 (0.61) NFKB1KDM4AUSP2NSD2ALPL
SCHEMBL2777698 0.74 GNG2 (0.69) NFKB1KDM4AUSP2NSD2ALPL
SCHEMBL2779337 0.73 GNG2 (1.00) NFKB1KDM4AUSP2NSD2ALPL
SCHEMBL13891703 0.71 GNG2 (0.57) NFKB1KDM4AUSP2NSD2ALPL
SCHEMBL2848109 0.71 GNG2 (0.65) NFKB1KDM4AUSP2NSD2ALPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022071595-A1 DENTAL CERAMIC COLORING SOLUTION クラレノリタケデンタル株式会社 2022-04-07 WO disclosed
WO-2022071597-A1 DENTAL CERAMIC COLORING SOLUTION クラレノリタケデンタル株式会社 2022-04-07 WO disclosed
WO-2022071594-A1 DENTAL CERAMIC COLORING SOLUTION クラレノリタケデンタル株式会社 2022-04-07 WO disclosed