Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | STAT3 | P40763 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | G6PD | P11413 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | GFER | P55789 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7937565 | 0.89 | PTGS2 (0.51) | CYP1A2GAAKMT2AMEN1ESR1 | |
| SCHEMBL9053535 | 0.85 | CYP1A2 (0.51) | CYP1A2GAAKMT2AMEN1ESR1 | |
| SCHEMBL9053867 | 0.83 | ALDH1A1 (0.48) | CYP1A2GAAKMT2AMEN1MAPT | |
| SCHEMBL9056190 | 0.81 | GAA (0.41) | CYP1A2GAAKMT2AMEN1ESR1 | |
| SCHEMBL9052978 | 0.81 | PTGS2 (0.47) | KMT2AMEN1MAPTALDH1A1LMNA | |
| SCHEMBL9054847 | 0.81 | HTT (0.54) | CYP1A2GAAKMT2AMEN1ESR1 | |
| SCHEMBL9053651 | 0.80 | KMT2A (0.50) | CYP1A2GAAKMT2AMEN1ESR1 | |
| SCHEMBL7931629 | 0.78 | ALDH1A1 (0.53) | GAAKMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL9054697 | 0.77 | KMT2A (0.47) | GAAKMT2AMEN1ESR1ESR2 | |
| SCHEMBL7632373 | 0.76 | GAA (0.53) | GAAKMT2AMEN1ESR1ESR2 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1996008483-A1 | GALLIC ACID DERIVATIVES, METHOD FOR THEIR PREPARATION AND THEIR USE AS DRUGS | ROUSSEL UCLAF (FR) | 1996-03-21 | — | — | WO | disclosed |