Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 7/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | MEN1 | O00255 | 3/20 | 0.60 |
| ▸ | MAPT | P10636 | 3/20 | 0.60 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.60 |
| ▸ | GMNN | O75496 | 1/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | TP53 | P04637 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | THRB | P10828 | 1/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.60 |
| ▸ | HPGD | P15428 | 1/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.60 |
| ▸ | RECQL | P46063 | 1/20 | 0.60 |
| ▸ | RAB9A | P51151 | 1/20 | 0.60 |
| ▸ | BLM | P54132 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL7367632 | 0.99 | TTR (0.59) | TTRKMT2AALDH1A1MEN1MAPT | |
| SCHEMBL11880101 | 0.85 | AURKB (0.70) | KMT2AALDH1A1MEN1MAPTGPR35 | |
| SCHEMBL15294424 | 0.84 | TTR (0.56) | TTRKMT2AALDH1A1MEN1MAPT | |
| Bromide SCHEMBL11874976 | 0.84 | AURKB (0.68) | KMT2AALDH1A1MEN1MAPTGPR35 | |
| SCHEMBL6770869 | 0.81 | HSD17B14 (0.64) | TTRKMT2AALDH1A1MEN1MAPT | |
| SCHEMBL7047895 | 0.80 | TTR (0.73) | TTRKMT2AALDH1A1MEN1MAPT | |
| SCHEMBL20100854 | 0.79 | COMT (0.72) | TTRKMT2AALDH1A1MEN1MAPT | |
| SCHEMBL3583870 | 0.79 | TTR (0.61) | TTRKMT2AALDH1A1MEN1MAPT | |
| SCHEMBL7368380 | 0.79 | TTR (0.81) | TTRKMT2AALDH1A1MEN1MAPT | |
| SCHEMBL20100827 | 0.78 | FTO (0.59) | TTRKMT2AALDH1A1MEN1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0237929-B1 | 3,5-DISUBSTITUTED PYROCATECHOL DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1993-06-02 | — | — | EP | disclosed |