Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.33 |
| ▸ | DAO | P14920 | 2/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.33 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.33 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA3 | P07451 | 1/20 | 0.33 |
| ▸ | CA6 | P23280 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | DPYD | Q12882 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.30 |
| ▸ | MMP3 | P08254 | 1/20 | 0.30 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL335180 | 0.71 | — | — | |
| SCHEMBL8988445 | 0.67 | — | — | |
| Sulfurous Acid SCHEMBL11600401 | 0.64 | CA2 (0.57) | CA2CYP2A6ALDH1A1CA12CA3 | |
| SCHEMBL25178167 | 0.62 | CYP2A6 (0.34) | CA2DAOCYP2A6IMPDH2IMPDH1 | |
| SCHEMBL2503454 | 0.61 | CA2 (0.69) | CA2CYP2A6ALDH1A1CA12CA3 | |
| Water SCHEMBL28189314 | 0.61 | CA2 (0.69) | CA2CYP2A6ALDH1A1CA12CA3 | |
| SCHEMBL45942 | 0.61 | CA2 (0.69) | CA2CYP2A6ALDH1A1CA12CA3 | |
| Water SCHEMBL28254092 | 0.61 | CA2 (0.69) | CA2CYP2A6ALDH1A1CA12CA3 | |
| SCHEMBL1824866 | 0.59 | CA2 (0.50) | CA2CYP2A6ALDH1A1CA12CA3 | |
| SCHEMBL28829194 | 0.59 | CA2 (0.65) | CA2CYP2A6ALDH1A1CA12CA3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-10287653-A | — | — | None | — | — | JP | disclosed |
| JP-10087626-A | — | — | None | — | — | JP | disclosed |
| JP-H10287653-A | PRODUCTION OF 2-HALOGENO-5-CYANOPYRIDINE | KURARAY CO LTD | 1998-10-27 | — | — | JP | disclosed |
| JP-H1087626-A | 5-CYANO-2-SULFONYLPYRIDINE AND ITS PRODUCTION | KURARAY CO LTD | 1998-04-07 | — | — | JP | disclosed |