Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 5/20 | 0.76 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.51 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.51 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.48 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.48 |
| ▸ | CASP3 | P42574 | 1/20 | 0.47 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.46 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.46 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28158032 | 0.87 | EGFR (0.76) | EGFRPDGFRBPDGFRAMAP4K4CYP11B1 | |
| SCHEMBL668493 | 0.86 | EGFR (1.00) | EGFRPDGFRBPDGFRANPC1RAB9A | |
| SCHEMBL30241125 | 0.86 | EGFR (1.00) | EGFRPDGFRBPDGFRANPC1RAB9A | |
| SCHEMBL29517021 | 0.86 | EGFR (1.00) | EGFRPDGFRBPDGFRANPC1RAB9A | |
| Hydrochloric Acid SCHEMBL28023744 | 0.85 | EGFR (0.96) | EGFRPDGFRBPDGFRANPC1RAB9A | |
| SCHEMBL8641138 | 0.84 | EGFR (0.64) | EGFRFGFR4 | |
| SCHEMBL27991038 | 0.81 | EGFR (0.53) | EGFRPDGFRBPDGFRAFGFR4 | |
| SCHEMBL21982453 | 0.80 | EGFR (0.57) | EGFRMAP4K4NPC1CYP11B1CYP11B2 | |
| SCHEMBL28127970 | 0.79 | EGFR (0.68) | EGFRPDGFRBPDGFRANPC1RAB9A | |
| SCHEMBL28127969 | 0.79 | EGFR (0.68) | EGFRPDGFRBPDGFRANPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-102675222-B | Method for preparing multi-substituted quinazoline and heterocyclic pyrimidine derivative | UNIV TSINGHUA | 2014-11-26 | — | — | CN | disclosed |
| CN-102675223-B | Preparation method for polysubstitution quinazoline and heterocyclic ring pyrimidine derivative | UNIV TSINGHUA | 2014-08-27 | — | — | CN | disclosed |