Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FEN1 | P39748 | 2/20 | 0.43 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA7 | P43166 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.38 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.38 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.38 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | F2R | P25116 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL728208 | 0.80 | CA12 (0.53) | CA12CA1CA2CA7CA9 | |
| SCHEMBL17114405 | 0.79 | POLB (0.47) | FEN1ERCC5POLBMEN1CYP1A2 | |
| SCHEMBL17114462 | 0.79 | CA12 (0.52) | CA12CA1CA2CA7CA9 | |
| SCHEMBL11599125 | 0.76 | ALDH1A1 (0.41) | FEN1ERCC5L3MBTL1TDP1HPGD | |
| SCHEMBL7598628 | 0.76 | CA12 (0.43) | L3MBTL1TDP1CA12CA1CA2 | |
| SCHEMBL4735543 | 0.74 | NLRP3 (0.53) | L3MBTL1TDP1CA12CA1CA2 | |
| SCHEMBL2263377 | 0.74 | CTNNB1 (0.54) | FEN1ERCC5TDP1TAS1R3TAS1R1 | |
| SCHEMBL1109662 | 0.73 | ERCC5 (0.64) | FEN1ERCC5TDP1POLBHPGD | |
| SCHEMBL3864104 | 0.72 | NPC1 (0.58) | L3MBTL1TDP1GAAMEN1KMT2A | |
| SCHEMBL17317414 | 0.71 | TSHR (0.52) | CA12CA1CA2CA7CA9 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105111084-A | Synthesis method of 4-substituted-3-methyl-2,4-dioxobutyrate | UNIV TAIZHOU | 2015-12-02 | — | — | CN | disclosed |