Pyrogallol

Pyrogallol

SCHEMBL4255147

CCS(=O)(=O)O.CS(=O)(=O)O.Oc1cccc(O)c1O.Oc1cccc(O)c1O

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

FGFR1FGFR2FGFR3FGFR4FLT1FLT4KDRPDGFRAPDGFRB

The experimentally established mechanism targets of Pyrogallol. 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
CA1 P00915 3/20 0.52
CA2 P00918 3/20 0.52
ALDH1A1 P00352 2/20 0.52
LMNA P02545 2/20 0.52
HPGD P15428 2/20 0.52
ALOX15 P16050 2/20 0.52
HSD17B10 Q99714 2/20 0.52
ADAMTS4 O75173 1/20 0.52
EGFR P00533 1/20 0.52
FYN P06241 1/20 0.52
MMP2 P08253 1/20 0.52
MMP9 P14780 1/20 0.52
MMP8 P22894 1/20 0.52
CA6 P23280 1/20 0.52
CDK2 P24941 1/20 0.52
MMP12 P39900 1/20 0.52
RECQL P46063 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
ADAMTS5 Q9UNA0 1/20 0.52
TRPA1 O75762 1/20 0.43

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 SCHEMBL1056082 0.96 ALDH1A1 (0.57) CA1CA2ALDH1A1LMNAHPGD
Pyrogallol SCHEMBL214769 0.91 ALDH1A1 (0.63) CA1CA2ALDH1A1LMNAHPGD
Pyrogallol SCHEMBL209233 0.91 ALDH1A1 (0.63) CA1CA2ALDH1A1LMNAHPGD
Catechol SCHEMBL27897383 0.81 SMN1; SMN2 (0.53) CA1CA2ALDH1A1LMNAHPGD
Pyrogallol SCHEMBL17768460 0.81 ALDH1A1 (0.71) CA1CA2ALDH1A1LMNAHPGD
Pyrogallol SCHEMBL28963965 0.79 ALDH1A1 (0.67) CA1CA2ALDH1A1LMNAHPGD
SCHEMBL27897384 0.78 TRPA1 (0.74) CA1CA2ALDH1A1LMNAHPGD
Pyrogallol SCHEMBL29044406 0.78 ALDH1A1 (0.75) CA1CA2ALDH1A1LMNAHPGD
Pyrogallol SCHEMBL2882287 0.77 ALDH1A1 (0.47) CA1CA2ALDH1A1LMNAHPGD
Hydroquinone SCHEMBL21354196 0.77 ENPP2 (0.54) CA1CA2ALDH1A1LMNAHPGD

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-20090252932-A1 ACTINIC ENERGY RAY CURABLE RESION COMPOSITION AND USE THEREOF KURARAY CO., LTD. (JP) 2009-10-08 US disclosed