Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.42 |
| ▸ | KDM1A | O60341 | 4/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.38 |
| ▸ | PRKDC | P78527 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 1/20 | 0.36 |
| ▸ | SMO | Q99835 | 2/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | GPR183 | P32249 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL17127848 | 1.00 | HRH4 (0.42) | HRH4KDM1ALRRK2HRH3PRKDC | |
| SCHEMBL21336664 | 1.00 | HRH4 (0.42) | HRH4KDM1ALRRK2HRH3PRKDC | |
| SCHEMBL18436076 | 0.90 | HRH4 (0.42) | HRH4KDM1ALRRK2HRH3PRKDC | |
| SCHEMBL18436075 | 0.90 | HRH4 (0.42) | HRH4KDM1ALRRK2HRH3PRKDC | |
| SCHEMBL17127887 | 0.90 | HRH4 (0.42) | HRH4KDM1ALRRK2HRH3PRKDC | |
| SCHEMBL17127921 | 0.89 | SMO (0.44) | HRH4KDM1ALRRK2ALDH1A1KDM4E | |
| SCHEMBL18436199 | 0.89 | SMO (0.44) | HRH4KDM1ALRRK2ALDH1A1KDM4E | |
| SCHEMBL17128085 | 0.89 | HRH4 (0.41) | HRH4KDM1ALRRK2HRH3PRKDC | |
| SCHEMBL17127854 | 0.89 | HRH4 (0.41) | HRH4KDM1ALRRK2HRH3PRKDC | |
| SCHEMBL18436812 | 0.89 | HRH4 (0.41) | HRH4KDM1ALRRK2HRH3PRKDC |
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 |
|---|---|---|---|---|---|---|---|
| EP-3124482-A1 | QUINOLINE DERIVATIVES AS SMO INHIBITORS | GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) | 2017-02-01 | — | — | EP | disclosed |