Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 4/20 | 0.48 |
| ▸ | CSF1R | P07333 | 1/20 | 0.47 |
| ▸ | AKT1 | P31749 | 1/20 | 0.46 |
| ▸ | MAP4K4 | O95819 | 4/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 10/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 10/20 | 0.45 |
| ▸ | CLK4 | Q9HAZ1 | 9/20 | 0.45 |
| ▸ | LMNA | P02545 | 6/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 5/20 | 0.45 |
| ▸ | USP2 | O75604 | 5/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL30964408 | 0.87 | EGFR (0.43) | EGFRCSF1RAKT1MAP4K4CYP1A2 | |
| SCHEMBL30964359 | 0.86 | EGFR (0.45) | EGFRCSF1RAKT1MAP4K4CYP1A2 | |
| SCHEMBL30964508 | 0.85 | EGFR (0.44) | EGFRCSF1RAKT1MAP4K4CYP1A2 | |
| SCHEMBL8090078 | 0.84 | EGFR (0.48) | EGFRCSF1RAKT1CYP1A2CYP2D6 | |
| SCHEMBL30964485 | 0.83 | IRAK4 (0.44) | EGFRCSF1RAKT1MAP4K4CYP1A2 | |
| SCHEMBL8646161 | 0.83 | EGFR (0.48) | EGFRCSF1RAKT1MAP4K4CYP1A2 | |
| Hydrochloric Acid SCHEMBL8646103 | 0.83 | EGFR (0.47) | EGFRCSF1RAKT1CYP1A2CYP2D6 | |
| SCHEMBL30964366 | 0.82 | EGFR (0.40) | EGFRCSF1RAKT1MAP4K4CYP1A2 | |
| SCHEMBL30964500 | 0.81 | EGFR (0.51) | EGFRCSF1RCYP1A2CYP3A4CLK4 | |
| SCHEMBL30964354 | 0.81 | CYP1A2 (0.47) | EGFRCSF1RMAP4K4CYP1A2CYP3A4 |
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 |