Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.40 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | NFKBIA | P25963 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27800307 | 0.78 | ABCG2 (0.49) | SMN1; SMN2KMT2AMAPTMEN1ALDH1A1 | |
| SCHEMBL847768 | 0.76 | RHOA (0.45) | SMN1; SMN2KMT2AMAPTMEN1ALDH1A1 | |
| SCHEMBL847767 | 0.76 | RHOA (0.45) | SMN1; SMN2KMT2AMAPTMEN1ALDH1A1 | |
| SCHEMBL847983 | 0.75 | ALDH1A1 (0.44) | SMN1; SMN2KMT2AMAPTMEN1ALDH1A1 | |
| SCHEMBL848595 | 0.74 | KMT2A (0.53) | SMN1; SMN2KMT2AMAPTMEN1ALDH1A1 | |
| SCHEMBL27800308 | 0.74 | ABCG2 (0.47) | SMN1; SMN2KMT2AMAPTMEN1ALDH1A1 | |
| SCHEMBL6642187 | 0.72 | AKR1C3 (0.57) | SMN1; SMN2KMT2AMAPTMEN1ALDH1A1 | |
| SCHEMBL6643376 | 0.71 | AKR1C3 (0.52) | SMN1; SMN2KMT2AMAPTMEN1ALDH1A1 | |
| SCHEMBL6644658 | 0.70 | KMT2A (0.51) | SMN1; SMN2KMT2AMAPTMEN1ALDH1A1 | |
| SCHEMBL6645636 | 0.69 | ABCG2 (0.50) | SMN1; SMN2KMT2AMAPTMEN1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2148862-A1 | DIHYDROQUINONE AND DIHYDRONAPHTHRIDINE INHIBITORS OF JNK | F. Hoffmann-Roche AG (CH) | 2010-02-03 | — | — | EP | disclosed |
| WO-2008138920-A1 | DIHYDROQUINONE AND DIHYDRONAPHTHRIDINE INHIBITORS OF JNK | F. HOFFMANN-LA ROCHE AG (CH) | 2008-11-20 | — | — | WO | disclosed |