Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 16/20 | 0.58 |
| ▸ | GAK | O14976 | 3/20 | 0.58 |
| ▸ | FBP1 | P09467 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.53 |
| ▸ | ERBB4 | Q15303 | 2/20 | 0.53 |
| ▸ | RIPK2 | O43353 | 2/20 | 0.52 |
| ▸ | BUB1 | O43683 | 2/20 | 0.52 |
| ▸ | STK10 | O94804 | 2/20 | 0.52 |
| ▸ | MAP3K1 | Q13233 | 2/20 | 0.52 |
| ▸ | PIP4K2C | Q8TBX8 | 2/20 | 0.52 |
| ▸ | SLK | Q9H2G2 | 2/20 | 0.52 |
| ▸ | CARS1 | P49589 | 1/20 | 0.52 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.51 |
| ▸ | PLK4 | O00444 | 1/20 | 0.51 |
| ▸ | CIT | O14578 | 1/20 | 0.51 |
| ▸ | AURKA | O14965 | 1/20 | 0.51 |
| ▸ | EPHB6 | O15197 | 1/20 | 0.51 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL1507715 | 0.81 | ABCG2 (0.71) | EGFRGAKFBP1ALDH1A1MAPT | |
| SCHEMBL7982836 | 0.81 | EGFR (0.63) | EGFRGAKFBP1ALDH1A1MAPT | |
| SCHEMBL29894409 | 0.79 | ABCG2 (0.76) | EGFRGAKFBP1ALDH1A1MAPT | |
| SCHEMBL183355 | 0.79 | ABCG2 (0.76) | EGFRGAKFBP1ALDH1A1MAPT | |
| SCHEMBL1507464 | 0.79 | EGFR (0.70) | EGFRGAKFBP1ALDH1A1MAPT | |
| SCHEMBL7966427 | 0.78 | EGFR (0.61) | EGFRERBB2RETFLT1KDR | |
| SCHEMBL7976867 | 0.78 | EGFR (0.70) | EGFRGAKFBP1ALDH1A1MAPT | |
| SCHEMBL642044 | 0.78 | EGFR (0.69) | EGFRGAKFBP1ALDH1A1MAPT | |
| SCHEMBL30804558 | 0.78 | EGFR (0.65) | EGFRGAKFBP1ALDH1A1MAPT | |
| SCHEMBL1507534 | 0.78 | EGFR (0.65) | EGFRGAKFBP1ALDH1A1MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009070328-A1 | MODULATORS OF THE EPIDERMAL GROWTH FACTOR RECEPTOR (EGFR) PATHWAY FOR USE IN THE TREATMENT OR PREVENTION OF SUBSTANCE ABUSE | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2009-06-04 | — | — | WO | disclosed |
| US-6225318-B1 | 4-aminoquinazolone derivatives | PFIZER INC | 2001-05-01 | — | — | US | disclosed |
| EP-0837063-A1 | 4-Aminoquinazoline derivatives | PFIZER INC. (US) | 1998-04-22 | — | — | EP | disclosed |