Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATIC | P31939 | 3/20 | 0.43 |
| ▸ | SHMT1 | P34896 | 3/20 | 0.43 |
| ▸ | SHMT2 | P34897 | 3/20 | 0.43 |
| ▸ | GART | P22102 | 2/20 | 0.41 |
| ▸ | TLR7 | Q9NYK1 | 8/20 | 0.37 |
| ▸ | DHFR | P00374 | 2/20 | 0.34 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.31 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.31 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 3/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | GLA | P06280 | 2/20 | 0.30 |
| ▸ | GAA | P10253 | 2/20 | 0.30 |
| ▸ | MAPT | P10636 | 2/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8563771 | 0.81 | TLR7 (0.45) | ATICSHMT1SHMT2GARTTLR7 | |
| SCHEMBL8569300 | 0.75 | ATIC (0.33) | ATICSHMT1SHMT2GARTHPGD | |
| SCHEMBL8564137 | 0.75 | ATIC (0.75) | ATICSHMT1SHMT2GART | |
| SCHEMBL8564142 | 0.75 | ATIC (0.75) | ATICSHMT1SHMT2GART | |
| SCHEMBL9001785 | 0.73 | TLR7 (0.44) | ATICSHMT1SHMT2GARTTLR7 | |
| SCHEMBL5050275 | 0.71 | HPGD (0.42) | HPGDALDH1A1 | |
| SCHEMBL9439883 | 0.71 | FOLR1 (0.44) | GART | |
| SCHEMBL8571595 | 0.71 | TLR7 (0.38) | TLR7DHFRHPGDKDM4EALDH1A1 | |
| SCHEMBL9439499 | 0.70 | DHFR (0.46) | GARTDHFRSIRT2SIRT1SIRT3 | |
| SCHEMBL8570678 | 0.70 | ATIC (0.38) | ATICSHMT1SHMT2GARTTLR7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0530579-B1 | Condensed pyrimidine derivatives antitumor agents | EISAI CO LTD (JP) | 1998-11-11 | — | — | EP | disclosed |
| US-5554615-A | ANTITUMOR | EISAI CO., LTD. (JP) | 1996-09-10 | — | — | US | disclosed |
| EP-0530579-A1 | Condensed pyrimidine derivatives antitumor agents | Eisai Co., Ltd. (JP) | 1993-03-10 | — | — | EP | disclosed |