Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 7/20 | 0.75 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.75 |
| ▸ | XIAP | P98170 | 2/20 | 0.75 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.75 |
| ▸ | EGFR | P00533 | 12/20 | 0.54 |
| ▸ | ERBB4 | Q15303 | 10/20 | 0.54 |
| ▸ | ERBB2 | P04626 | 5/20 | 0.54 |
| ▸ | JAK3 | P52333 | 1/20 | 0.54 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.47 |
| ▸ | EPHB2 | P29323 | 1/20 | 0.47 |
| ▸ | BIRC3 | Q13489 | 1/20 | 0.43 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL15050523 | 1.00 | CYP3A4 (0.75) | CYP3A4CYP2C9XIAPCYP2C19EGFR | |
| SCHEMBL15050524 | 1.00 | CYP3A4 (0.75) | CYP3A4CYP2C9XIAPCYP2C19EGFR | |
| Hydrochloric Acid SCHEMBL15050659 | 0.99 | CYP3A4 (0.74) | CYP3A4CYP2C9XIAPCYP2C19EGFR | |
| Hydrochloric Acid SCHEMBL158209 | 0.99 | CYP3A4 (0.74) | CYP3A4CYP2C9XIAPCYP2C19EGFR | |
| Hydrochloric Acid SCHEMBL15050655 | 0.99 | CYP3A4 (0.74) | CYP3A4CYP2C9XIAPCYP2C19EGFR | |
| SCHEMBL156665 | 0.95 | CYP3A4 (0.80) | CYP3A4CYP2C9XIAPCYP2C19EGFR | |
| SCHEMBL156666 | 0.95 | CYP3A4 (0.80) | CYP3A4CYP2C9XIAPCYP2C19EGFR | |
| SCHEMBL158420 | 0.95 | CYP3A4 (0.80) | CYP3A4CYP2C9XIAPCYP2C19EGFR | |
| Hydrochloric Acid SCHEMBL159948 | 0.95 | CYP3A4 (0.79) | CYP3A4CYP2C9XIAPCYP2C19EGFR | |
| SCHEMBL160542 | 0.95 | CYP3A4 (0.79) | CYP3A4CYP2C9XIAPCYP2C19EGFR |
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 4 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 | claimed |
| WO-2012030160-A2 | QUINOLINE OR QUINAZOLINE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS | HANMI HOLDINGS CO., LTD. (KR) | 2012-03-08 | — | — | WO | claimed |
| 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 |