Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.45 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.45 |
| ▸ | CYP4Z1 | Q86W10 | 2/20 | 0.43 |
| ▸ | SYK | P43405 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | CYP4F11 | Q9HBI6 | 1/20 | 0.40 |
| ▸ | CYP4F12 | Q9HCS2 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | P2RX3 | P56373 | 3/20 | 0.39 |
| ▸ | STK17A | Q9UEE5 | 3/20 | 0.39 |
| ▸ | STK17B | O94768 | 1/20 | 0.39 |
| ▸ | XDH | P47989 | 1/20 | 0.39 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.38 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.38 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16264828 | 1.00 | EGFR (0.45) | EGFRFGFR1CYP4Z1SYKKDM4E | |
| SCHEMBL16264889 | 0.88 | STK17A (0.41) | EGFRFGFR1SYKKDM4EHTT | |
| SCHEMBL16245555 | 0.87 | P2RX3 (0.44) | SYKKDM4EHTTAURKAP2RX3 | |
| SCHEMBL16264934 | 0.86 | RPS6KA3 (0.41) | EGFRFGFR1SYKP2RX3 | |
| SCHEMBL16245559 | 0.86 | CYSLTR2 (0.44) | SYKKDM4EHTTAURKATDP1 | |
| SCHEMBL16264901 | 0.79 | MEN1 (0.41) | EGFRKDM4EGAANPSR1STK17A | |
| SCHEMBL16264858 | 0.75 | CYP4Z1 (0.58) | CYP4Z1CYP4F11CYP4F12GAAMAPK1 | |
| SCHEMBL18869322 | 0.74 | P2RX3 (0.43) | SYKKDM4EHTTTDP1P2RX3 | |
| SCHEMBL9744594 | 0.74 | CYP4Z1 (0.59) | CYP4Z1CYP4F11CYP4F12GAAMAPK1 | |
| SCHEMBL9671800 | 0.73 | CYP4Z1 (0.65) | CYP4Z1CYP4F11CYP4F12GAAMAPK1 |
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-2014180524-A1 | MACROCYCLES AS KINASE INHIBITORS | MERCK PATENT GMBH (DE) | 2014-11-13 | — | — | WO | disclosed |