Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 16/20 | 0.73 |
| ▸ | FADS1 | O60427 | 1/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.64 |
| ▸ | MAPT | P10636 | 3/20 | 0.64 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.64 |
| ▸ | MEN1 | O00255 | 2/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.64 |
| ▸ | NPC1 | O15118 | 1/20 | 0.64 |
| ▸ | PRNP | P04156 | 1/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.64 |
| ▸ | HTT | P42858 | 1/20 | 0.64 |
| ▸ | LCK | P06239 | 2/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.60 |
| ▸ | FBP1 | P09467 | 2/20 | 0.60 |
| ▸ | GMNN | O75496 | 1/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL7981320 | 0.85 | EGFR (0.73) | EGFRKDM4EERBB2CYP1A2CYP3A4 | |
| SCHEMBL2988440 | 0.84 | EGFR (1.00) | EGFRERBB2MEN1KMT2AFBP1 | |
| SCHEMBL7975392 | 0.84 | EGFR (0.73) | EGFRERBB2HTTMAPK1HIF1A | |
| SCHEMBL4740556 | 0.84 | EGFR (0.72) | EGFRFADS1KDM4EMAPTERBB2 | |
| SCHEMBL4737994 | 0.83 | EGFR (0.67) | EGFRFADS1KDM4EMAPTERBB2 | |
| SCHEMBL4738649 | 0.83 | EGFR (0.80) | EGFRFADS1KDM4EMAPTERBB2 | |
| SCHEMBL11902904 | 0.83 | GRM1 (0.64) | EGFRERBB2MEN1KMT2AFBP1 | |
| SCHEMBL7965118 | 0.82 | EGFR (0.73) | EGFRMAPTHTTLMNATP53 | |
| SCHEMBL7976884 | 0.82 | EGFR (1.00) | EGFRFADS1KDM4EMAPTERBB2 | |
| SCHEMBL4355658 | 0.82 | EGFR (1.00) | EGFRFADS1KDM4EMAPTERBB2 |
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-1997026259-A1 | IMPROVED PROCESS FOR PREPARING 4,6-DISUBSTITUTED PYRIDO[3,4-d]PYRIMIDINES | WARNER-LAMBERT COMPANY (US) | 1997-07-24 | — | — | WO | claimed |
| US-6313292-B1 | REACTION FROM 5-AMINO-2-FLUOROPYRIDINE; AMINATION, CYCLIZATION, CHLORINATION, SALT FORMATION, DECHLORINATION, DEBLOCKING | WARNER-LAMBERT COMPANY | 2001-11-06 | — | — | US | disclosed |
| WO-1997026259-A1 | IMPROVED PROCESS FOR PREPARING 4,6-DISUBSTITUTED PYRIDO[3,4-d]PYRIMIDINES | WARNER-LAMBERT COMPANY (US) | 1997-07-24 | — | — | WO | disclosed |