Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | PCK1 | P35558 | 3/20 | 0.42 |
| ▸ | HCAR1 | Q9BXC0 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | DAO | P14920 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | PNP | P00491 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | GUCY1A1 | Q02108 | 1/20 | 0.35 |
| ▸ | GUCY1B1 | Q02153 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28043739 | 0.79 | ALDH1A1 (0.54) | KMT2APCK1MEN1ALDH1A1DAO | |
| SCHEMBL7417864 | 0.74 | HCAR1 (0.42) | KMT2AHCAR1MEN1ALDH1A1HPGD | |
| SCHEMBL9235490 | 0.72 | PNP (0.67) | PNP | |
| SCHEMBL7416425 | 0.71 | PNP (0.47) | KMT2AMEN1HPGDPNPMAPT | |
| SCHEMBL7423403 | 0.69 | KMT2A (0.48) | KMT2AMEN1ALDH1A1PNPMAPT | |
| SCHEMBL7604058 | 0.68 | PNP (0.51) | KMT2ADAOPNPMAPT | |
| SCHEMBL28043744 | 0.68 | CYP1A2 (0.52) | KMT2AMEN1ALDH1A1HPGDMAPT | |
| SCHEMBL8422905 | 0.67 | KMT2A (0.42) | KMT2AMEN1ALDH1A1HPGDMAPT | |
| SCHEMBL7422829 | 0.67 | PNP (0.49) | KMT2AMEN1ALDH1A1HPGDPNP | |
| SCHEMBL28043741 | 0.66 | KMT2A (0.50) | KMT2AMEN1ALDH1A1DAOMAPT |
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-0825993-A1 | XANTHINES AND THEIR THERAPEUTIC USE | Chiroscience Limited (GB) | 1998-03-04 | — | — | EP | claimed |
| WO-1996036638-A1 | XANTHINES AND THEIR THERAPEUTIC USE | CHIROSCIENCE LIMITED (GB) | 1996-11-21 | — | — | WO | claimed |