Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYMS | P04818 | 4/20 | 0.53 |
| ▸ | GART | P22102 | 2/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | FOLR1 | P15328 | 6/20 | 0.43 |
| ▸ | NAALAD2 | Q9Y3Q0 | 1/20 | 0.42 |
| ▸ | FOLR2 | P14207 | 3/20 | 0.41 |
| ▸ | ATIC | P31939 | 2/20 | 0.41 |
| ▸ | SLC19A1 | P41440 | 2/20 | 0.41 |
| ▸ | SLC46A1 | Q96NT5 | 2/20 | 0.41 |
| ▸ | DHFR | P00374 | 1/20 | 0.41 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9828665 | 1.00 | TYMS (0.53) | TYMSGARTCA2CA1FOLR1 | |
| SCHEMBL9379640 | 0.86 | TYMS (0.56) | TYMSGARTCA2CA1FOLR1 | |
| SCHEMBL9379643 | 0.86 | TYMS (0.56) | TYMSGARTCA2CA1FOLR1 | |
| SCHEMBL9829787 | 0.86 | TYMS (0.55) | TYMSGARTCA2CA1FOLR1 | |
| SCHEMBL27513231 | 0.86 | TYMS (0.55) | TYMSGARTCA2CA1FOLR1 | |
| SCHEMBL9829799 | 0.86 | TYMS (0.55) | TYMSGARTCA2CA1FOLR1 | |
| SCHEMBL9556165 | 0.79 | L3MBTL1 (0.47) | TYMSGARTDHFR | |
| SCHEMBL9556169 | 0.79 | L3MBTL1 (0.47) | TYMSGARTDHFR | |
| SCHEMBL27559568 | 0.78 | CA2 (0.53) | GARTCA2CA1FOLR1NAALAD2 | |
| SCHEMBL9600674 | 0.77 | CA2 (0.52) | TYMSGARTCA2CA1FOLR1 |
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-0239362-B1 | ANTI-TUMOR AGENTS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-12-04 | — | — | EP | disclosed |
| EP-0239362-A2 | Anti-tumor agents | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1987-09-30 | — | — | EP | disclosed |