Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.37 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.37 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.37 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 4/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2183306 | 0.94 | TP53 (0.41) | TP53EGFRFGFR1SRCFGFR2 | |
| SCHEMBL2181684 | 0.92 | FGFR1 (0.42) | TP53EGFRFGFR1SRCFGFR2 | |
| SCHEMBL2183395 | 0.92 | TP53 (0.47) | TP53EGFRFGFR1SRCFGFR2 | |
| SCHEMBL2180532 | 0.85 | CCND1 (0.35) | TP53EGFRFGFR1SRCFGFR2 | |
| SCHEMBL2182521 | 0.83 | LMNA (0.40) | CYP2C19HTTADORA2BKDM4ELMNA | |
| SCHEMBL2181859 | 0.83 | TSHR (0.36) | TP53EGFRFGFR1SRCFGFR2 | |
| SCHEMBL2181675 | 0.82 | CYP2D6 (0.49) | CYP2D6POLBMAPTTHRBBLM | |
| SCHEMBL2183080 | 0.82 | CYP2D6 (0.48) | CYP2D6POLBCYP2C19HTTGAA | |
| SCHEMBL2181496 | 0.82 | CYP2C19 (0.40) | CYP2D6POLBMAPTTHRBBLM | |
| SCHEMBL2183519 | 0.80 | TP53 (0.41) | TP53CYP2D6POLBMAPTTHRB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010014798-A2 | PYRIMIDOTRIAZINEDIONES AND PYRIMIDOPYRIMIDINEDIONES AND METHODS OF USING THE SAME | THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) | 2010-02-04 | — | — | WO | disclosed |