Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 4/20 | 0.37 |
| ▸ | PRKCA | P17252 | 3/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11399722 | 0.89 | ADRB2 (0.47) | ALDH1A1ADRB2GSK3BHTR6KDM4E | |
| SCHEMBL9867248 | 0.85 | MAT2A (0.39) | ALDH1A1ADRB2HTR6KDM4E | |
| SCHEMBL9868894 | 0.84 | ALDH1A1 (0.36) | ALDH1A1HTT | |
| SCHEMBL11393569 | 0.83 | PSEN1 (0.37) | ALDH1A1L3MBTL1 | |
| SCHEMBL9869020 | 0.81 | ALDH1A1 (0.37) | ALDH1A1HTR6KDM4EMAPK1HTT | |
| SCHEMBL7317623 | 0.81 | TP53 (0.38) | ALDH1A1GSK3BPRKCANTRK1KDM4E | |
| Flosequinan SCHEMBL5441172 | 0.80 | ATM (0.47) | ALDH1A1GSK3BPRKCAKDM4E | |
| Flosequinan SCHEMBL122877 | 0.80 | ATM (0.47) | ALDH1A1GSK3BPRKCAKDM4E | |
| Flosequinan SCHEMBL5442796 | 0.80 | ATM (0.47) | ALDH1A1GSK3BPRKCAKDM4E | |
| SCHEMBL10943341 | 0.80 | NTRK1 (0.40) | GSK3BNTRK1KDM4EMAPK1HTT |
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 |
|---|---|---|---|---|---|---|---|
| US-4302460-A | 4-Quinolinones having antihypertensive activity | THE BOOTS COMPANY LIMITED (GB) | 1981-11-24 | — | — | US | disclosed |