Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 5/20 | 0.33 |
| ▸ | CA12 | O43570 | 3/20 | 0.33 |
| ▸ | CA7 | P43166 | 2/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 5/20 | 0.33 |
| ▸ | ACHE | P22303 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CCR6 | P51684 | 1/20 | 0.32 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | SYK | P43405 | 1/20 | 0.32 |
| ▸ | F13A1 | P00488 | 1/20 | 0.32 |
| ▸ | TGM2 | P21980 | 1/20 | 0.32 |
| ▸ | TGM1 | P22735 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8284170 | 0.83 | SYK (0.44) | CA1CA12CA7CA14SYK | |
| SCHEMBL13622709 | 0.83 | SYK (0.44) | CA1CA12CA7CA14SYK | |
| SCHEMBL13622698 | 0.78 | SYK (0.43) | CA1CA12CA7CA14SYK | |
| SCHEMBL8282979 | 0.78 | SYK (0.43) | CA1CA12CA7CA14SYK | |
| SCHEMBL12601412 | 0.73 | SYK (0.43) | CA1CA12CA7CA14SYK | |
| SCHEMBL1190633 | 0.64 | ALDH1A1 (0.51) | ABCB1CCR6PAX8F13A1TGM2 | |
| SCHEMBL264989 | 0.63 | CCR6 (0.58) | SMN1; SMN2CCR6PAX8TDP1ALDH1A1 | |
| SCHEMBL23651643 | 0.62 | ALDH1A1 (0.56) | ABCB1SMN1; SMN2CCR6PAX8TDP1 | |
| SCHEMBL12130679 | 0.62 | KMT2A (0.50) | ABCB1CCR6PAX8TDP1ALDH1A1 | |
| SCHEMBL14006684 | 0.62 | CA12 (0.49) | ABCB1CA1CA12CA2SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1730142-B1 | NOVEL KETOAMIDES WITH CYCLIC P4'S AS INHIBITORS OF NS3 SERINE PROTEASE OF HEPATITIS C VIRUS | SCHERING CORP (US) | 2011-06-29 | — | — | EP | disclosed |