Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 17/20 | 0.61 |
| ▸ | ERBB2 | P04626 | 5/20 | 0.59 |
| ▸ | ERBB4 | Q15303 | 3/20 | 0.59 |
| ▸ | JAK3 | P52333 | 2/20 | 0.54 |
| ▸ | GAK | O14976 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL15050091 | 0.88 | CYP3A4 (0.65) | EGFRERBB2ERBB4JAK3GAK | |
| SCHEMBL15050088 | 0.88 | CYP3A4 (0.65) | EGFRERBB2ERBB4JAK3GAK | |
| Hydrochloric Acid SCHEMBL15050483 | 0.88 | CYP3A4 (0.65) | EGFRERBB2ERBB4JAK3GAK | |
| Hydrochloric Acid SCHEMBL15050486 | 0.88 | CYP3A4 (0.65) | EGFRERBB2ERBB4JAK3GAK | |
| SCHEMBL178188 | 0.84 | CYP3A4 (0.58) | EGFRERBB2CYP3A4 | |
| Hydrochloric Acid SCHEMBL176203 | 0.84 | CYP3A4 (0.56) | EGFRERBB2CYP3A4 | |
| SCHEMBL176198 | 0.83 | CYP3A4 (0.54) | EGFRERBB2ERBB4JAK3GAK | |
| Hydrochloric Acid SCHEMBL176332 | 0.83 | CYP3A4 (0.55) | EGFRERBB2CYP3A4 | |
| Hydrochloric Acid SCHEMBL176298 | 0.82 | EGFR (0.60) | EGFRERBB2CYP3A4 | |
| Hydrochloric Acid SCHEMBL176888 | 0.81 | EGFR (0.70) | EGFRERBB2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2611797-A2 | QUINOLINE OR QUINAZOLINE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS | Hanmi Science Co., Ltd. (KR) | 2013-07-10 | — | — | EP | disclosed |
| WO-2012030160-A2 | QUINOLINE OR QUINAZOLINE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS | HANMI HOLDINGS CO., LTD. (KR) | 2012-03-08 | — | — | WO | disclosed |