Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATIC | P31939 | 3/20 | 0.38 |
| ▸ | SHMT1 | P34896 | 3/20 | 0.38 |
| ▸ | SHMT2 | P34897 | 3/20 | 0.38 |
| ▸ | EP300 | Q09472 | 8/20 | 0.37 |
| ▸ | GART | P22102 | 2/20 | 0.36 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.32 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.32 |
| ▸ | SMO | Q99835 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
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 | 0.88 | TLR7 (0.45) | ATICSHMT1SHMT2EP300GART | |
| SCHEMBL9001785 | 0.82 | TLR7 (0.44) | ATICSHMT1SHMT2EP300GART | |
| SCHEMBL8563902 | 0.72 | TLR7 (0.50) | ATICSHMT1SHMT2EP300GART | |
| SCHEMBL8567733 | 0.71 | CRHBP (0.41) | EP300LMNAMAPTSMN1; SMN2SIRT2 | |
| SCHEMBL8562850 | 0.71 | CYP4A11 (0.35) | EP300SIRT2SIRT1CA12CA1 | |
| SCHEMBL8564673 | 0.70 | ATIC (0.43) | ATICSHMT1SHMT2GARTTLR7 | |
| SCHEMBL8571595 | 0.70 | TLR7 (0.38) | TLR7MAPTCA12CA1CA2 | |
| SCHEMBL8564228 | 0.69 | TLR7 (0.37) | TLR7MAPTCA12CA1CA2 | |
| SCHEMBL8564223 | 0.69 | TLR7 (0.37) | TLR7MAPTCA12CA1CA2 | |
| SCHEMBL8564668 | 0.68 | ATIC (0.48) | ATICSHMT1SHMT2EP300GART |
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 |