Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 10/20 | 0.58 |
| ▸ | EGFR | P00533 | 7/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | KDR | P35968 | 1/20 | 0.50 |
| ▸ | AXL | P30530 | 1/20 | 0.49 |
| ▸ | MET | P08581 | 6/20 | 0.49 |
| ▸ | GRM5 | P41594 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL17675235 | 0.88 | BTK (0.73) | BTKEGFRCYP3A4KDR | |
| SCHEMBL17675399 | 0.85 | BTK (0.81) | BTKEGFRCYP3A4KDRAXL | |
| SCHEMBL17675471 | 0.85 | BTK (0.52) | BTKEGFRCYP3A4KDRAXL | |
| SCHEMBL17675237 | 0.83 | EGFR (0.80) | BTKEGFRCYP3A4KDRAXL | |
| SCHEMBL17675239 | 0.78 | BTK (0.82) | BTKEGFRCYP3A4KDRAXL | |
| SCHEMBL17675303 | 0.76 | BTK (0.70) | BTKEGFRCYP3A4KDR | |
| SCHEMBL17675438 | 0.75 | BTK (0.59) | BTKEGFR | |
| SCHEMBL17675336 | 0.74 | BTK (0.63) | BTKEGFRCYP3A4KDRAXL | |
| SCHEMBL17683824 | 0.74 | BTK (1.00) | BTKEGFRCYP3A4KDRAXL | |
| SCHEMBL17675332 | 0.73 | BTK (0.70) | BTKEGFRKDR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016055982-A1 | QUINOLINE AND QUINAZOLINE COMPOUNDS | ACERTA PHARMA B.V. (NL) | 2016-04-14 | — | — | WO | disclosed |
| WO-2016055982-A1 | QUINOLINE AND QUINAZOLINE COMPOUNDS | ACERTA PHARMA B.V. (NL) | 2016-04-14 | — | — | WO | disclosed |