Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | EP300 | Q09472 | 11/20 | 0.32 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.32 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.32 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.32 |
| ▸ | TYK2 | P29597 | 2/20 | 0.32 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.32 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21336795 | 0.84 | NTRK1 (0.33) | KDM1AMAPK1NTRK1NTRK3NTRK2 | |
| SCHEMBL21336647 | 0.84 | KDM1A (0.36) | KDM1AEP300 | |
| SCHEMBL21336708 | 0.84 | HTR1A (0.36) | HTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL18436682 | 0.82 | RAD52 (0.38) | KDM1AIRAK4HTR1AADRA1DADRA1A | |
| SCHEMBL18436944 | 0.81 | GRIA2 (0.40) | IRAK4HTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL21336578 | 0.81 | TTK (0.32) | KDM1AMAPK1NTRK1NTRK3NTRK2 | |
| SCHEMBL18436729 | 0.80 | CD274 (0.43) | MAPK1 | |
| SCHEMBL18436820 | 0.79 | ACP1 (0.36) | IRAK4MAPK1 | |
| SCHEMBL18436919 | 0.79 | EGLN1 (0.36) | IRAK4DGAT2 | |
| SCHEMBL18436930 | 0.79 | POLB (0.39) | HTR1A |
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-3124482-B1 | QUINOLINE DERIVATIVES AS SMO INHIBITORS | GUANGDONG ZHONGSHENG PHARMACEUTICAL CO LTD (CN) | 2019-09-11 | — | — | EP | disclosed |
| EP-3124482-A1 | QUINOLINE DERIVATIVES AS SMO INHIBITORS | GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) | 2017-02-01 | — | — | EP | disclosed |