Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 15/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MLKL | Q8NB16 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3835605 | 0.90 | KDM4E (0.38) | AAK1KDM4ELMNAHSD17B10ALDH1A1 | |
| SCHEMBL27631254 | 0.82 | AAK1 (0.49) | AAK1KDM4ELMNAHSD17B10USP2 | |
| SCHEMBL5306800 | 0.74 | RAB9A (0.59) | KDM4EHSD17B10ALDH1A1HPGD | |
| SCHEMBL3836419 | 0.73 | NISCH (0.39) | AAK1KDM4ELMNAHSD17B10ALDH1A1 | |
| SCHEMBL549303 | 0.73 | SNCA (0.52) | KDM4ELMNAALDH1A1HPGDHTT | |
| SCHEMBL3830827 | 0.71 | KDM4E (0.36) | AAK1KDM4ELMNAHSD17B10MLKL | |
| SCHEMBL549129 | 0.71 | AAK1 (0.50) | AAK1KDM4EALDH1A1 | |
| SCHEMBL3830935 | 0.71 | KDM4E (0.46) | AAK1KDM4ELMNAHSD17B10ALDH1A1 | |
| SCHEMBL548446 | 0.70 | KMT2A (0.53) | AAK1KDM4EALDH1A1 | |
| SCHEMBL548492 | 0.70 | F10 (0.51) | AAK1KDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2121706-A1 | TETRAHYDROQUINOLINE DERIVATIVES AND USE OF SAME FOR TREATING CANCER | Merck Patent GmbH (DE) | 2009-11-25 | — | — | EP | disclosed |
| WO-2008113456-A1 | TETRAHYDROQUINOLINE DERIVATIVES AND USE OF SAME FOR TREATING CANCER | MERCK PATENT GMBH (DE) | 2008-09-25 | — | — | WO | disclosed |
| EP-1885702-A2 | QUINAZOLINONES | Merck Patent GmbH (DE) | 2008-02-13 | — | — | EP | disclosed |
| WO-2006125555-A2 | QUINAZOLINONES | MERCK PATENT GMBH (DE) | 2006-11-30 | — | — | WO | disclosed |