Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | CLEC4M | Q9H2X3 | 1/20 | 0.53 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.48 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.47 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7293954 | 0.85 | CYP3A4 (0.74) | CYP1A2CYP3A4CYP2C19CLEC4MGABRA1 | |
| SCHEMBL7290898 | 0.83 | CYP1A2 (0.60) | CYP1A2CYP3A4CYP2C19CLEC4MGABRA1 | |
| SCHEMBL3274638 | 0.83 | CYP1A2 (0.60) | CYP1A2CYP3A4CYP2C19CLEC4MGABRA1 | |
| SCHEMBL7284683 | 0.78 | CYP1A2 (0.59) | CYP1A2CYP3A4CYP2C19CLEC4MGABRA1 | |
| SCHEMBL3847939 | 0.76 | GABRA1 (0.73) | CYP1A2CYP2C19GABRA1GABRB2KMT2A | |
| SCHEMBL11639094 | 0.75 | CYP1A2 (0.70) | CYP1A2CYP3A4CYP2C19CLEC4MGABRA1 | |
| SCHEMBL9155124 | 0.74 | CYP3A4 (0.48) | CYP1A2CYP3A4CYP2C19CLEC4MGABRA1 | |
| SCHEMBL2977304 | 0.73 | GABRA1 (0.62) | CYP1A2CYP3A4CYP2C19CLEC4MGABRA1 | |
| SCHEMBL11641095 | 0.73 | CYP1A2 (0.63) | CYP1A2CYP3A4CYP2C19CLEC4MGABRA1 | |
| SCHEMBL1345017 | 0.73 | CYP1A2 (0.59) | CYP1A2CYP3A4CYP2C19CLEC4MGABRA1 |
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-0343574-B1 | 4(1H)-quinolone derivatives | KIRIN BREWERY (JP) | 1994-07-27 | — | — | EP | disclosed |
| US-5081121-A | Cardiotonic agents | KIRIN BEER KABUSHIKI KAISHA (JP) | 1992-01-14 | — | — | US | disclosed |