Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | AGXT | P21549 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP3 | P08254 | 1/20 | 0.39 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | APP | P05067 | 3/20 | 0.38 |
| ▸ | LDHA | P00338 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4258721 | 1.00 | CA1 (0.54) | CA1CA2IDO1AGXTHTT | |
| SCHEMBL4258715 | 0.88 | CA1 (0.53) | CA1CA2IDO1AGXTHTT | |
| SCHEMBL4256434 | 0.88 | CA1 (0.53) | CA1CA2IDO1AGXTHTT | |
| SCHEMBL4254989 | 0.85 | CA1 (0.44) | CA1CA2IDO1AGXTHTT | |
| SCHEMBL4259458 | 0.85 | CA1 (0.44) | CA1CA2IDO1AGXTHTT | |
| SCHEMBL4257566 | 0.81 | CA1 (0.52) | CA1CA2IDO1AGXTHTT | |
| SCHEMBL4258718 | 0.76 | CA1 (0.43) | CA1CA2IDO1AGXTHTT | |
| SCHEMBL24634748 | 0.75 | CA1 (0.70) | CA1CA2IDO1AGXTHTT | |
| SCHEMBL8082823 | 0.75 | CA1 (0.70) | CA1CA2IDO1AGXTHTT | |
| SCHEMBL6661512 | 0.74 | IDO1 (0.50) | CA1CA2IDO1AGXTHTT |
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-2009046098-A1 | NOVEL CYCLIC BORONATE INHIBITORS OF HCV REPLICATION | SMITHKLINE BEECHAM CORPORATION (US) | 2009-04-09 | — | — | WO | disclosed |