Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.42 |
| ▸ | XDH | P47989 | 3/20 | 0.40 |
| ▸ | SLC22A12 | Q96S37 | 3/20 | 0.40 |
| ▸ | FPR2 | P25090 | 1/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.39 |
| ▸ | BRAF | P15056 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | G6PD | P11413 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | TYR | P14679 | 1/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14031002 | 0.82 | XDH (0.48) | PDPK1XDHSLC22A12BRAFMEN1 | |
| SCHEMBL14005509 | 0.80 | XDH (0.43) | PDPK1XDHSLC22A12BRAFTYR | |
| SCHEMBL22042452 | 0.80 | PDPK1 (0.47) | PDPK1XDHSLC22A12CHRNB4CHRNA3 | |
| SCHEMBL14409688 | 0.78 | HPGD (0.54) | MEN1GAAG6PDKMT2AL3MBTL1 | |
| SCHEMBL5462060 | 0.76 | NPSR1 (0.63) | MEN1GAAKMT2AL3MBTL1NPC1 | |
| SCHEMBL4187435 | 0.74 | XDH (0.56) | PDPK1XDHSLC22A12CHRNB4CHRNA3 | |
| SCHEMBL13743490 | 0.74 | MKNK1 (0.53) | BRAFHCAR2CYP2A6 | |
| SCHEMBL13169061 | 0.73 | TSHR (0.42) | MEN1GAAG6PDKMT2AL3MBTL1 | |
| SCHEMBL14031014 | 0.73 | SCN10A (0.45) | CHRNB4CHRNA3GRM4CYP2A6SYK | |
| SCHEMBL1630903 | 0.72 | — | — |
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-2008109613-A1 | BENZO[C][2,7]NAPHTHYRIDINE DERIVATIVES, AND THEIR USE AS KINASE INHIBITORS | WYETH (US) | 2008-09-12 | — | — | WO | disclosed |