Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.53 |
| ▸ | BTK | Q06187 | 2/20 | 0.53 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.53 |
| ▸ | TEC | P42680 | 1/20 | 0.53 |
| ▸ | TXK | P42681 | 1/20 | 0.53 |
| ▸ | BLK | P51451 | 1/20 | 0.53 |
| ▸ | BMX | P51813 | 1/20 | 0.53 |
| ▸ | JAK3 | P52333 | 1/20 | 0.53 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.53 |
| ▸ | KDR | P35968 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 6/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | MMP13 | P45452 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL17675493 | 0.88 | BTK (0.68) | EGFRBTKERBB2TECTXK | |
| SCHEMBL17675208 | 0.86 | BTK (0.56) | EGFRBTKERBB2TECTXK | |
| SCHEMBL17675311 | 0.85 | BTK (0.66) | EGFRBTKKDRMAPTALDH1A1 | |
| SCHEMBL17675293 | 0.84 | EGFR (0.49) | EGFRBTKKDRMAPTKMT2A | |
| SCHEMBL17675440 | 0.83 | BTK (0.55) | EGFRBTKERBB2TECTXK | |
| SCHEMBL17675213 | 0.81 | EGFR (0.79) | EGFRBTKERBB2TECTXK | |
| SCHEMBL17675511 | 0.76 | KMT2A (0.55) | EGFRBTKERBB2TECTXK | |
| SCHEMBL17675289 | 0.73 | BTK (0.72) | EGFRBTKERBB2TECTXK | |
| SCHEMBL17675318 | 0.73 | BTK (0.66) | EGFRBTKERBB2TECTXK | |
| SCHEMBL17675515 | 0.72 | BTK (0.49) | EGFRBTKERBB2TECTXK |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016055982-A1 | QUINOLINE AND QUINAZOLINE COMPOUNDS | ACERTA PHARMA B.V. (NL) | 2016-04-14 | — | — | WO | disclosed |