Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 1/20 | 0.39 |
| ▸ | PSMB8 | P28062 | 7/20 | 0.35 |
| ▸ | PSMB5 | P28074 | 5/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | PSMB9 | P28065 | 3/20 | 0.35 |
| ▸ | PSMB10 | P40306 | 3/20 | 0.35 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.34 |
| ▸ | PSMB2 | P49721 | 2/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7772818 | 0.93 | CACNA1B (0.39) | CACNA1BPSMB8PSMB5ALDH1A1SMN1; SMN2 | |
| SCHEMBL7772779 | 0.92 | CACNA1B (0.48) | CACNA1BPSMB8PSMB5PSMB9BIRC2 | |
| SCHEMBL7768814 | 0.87 | CACNA1B (0.39) | CACNA1BPSMB8PSMB5ALDH1A1SMN1; SMN2 | |
| SCHEMBL7774825 | 0.86 | CACNA1B (0.44) | CACNA1BPSMB8PSMB5ALDH1A1SMN1; SMN2 | |
| SCHEMBL7768808 | 0.86 | CACNA1B (0.47) | CACNA1BPSMB8PSMB5PSMB9BIRC2 | |
| SCHEMBL7110470 | 0.86 | MEN1 (0.43) | CACNA1BPSMB8PSMB5ALDH1A1PSMB9 | |
| SCHEMBL7105591 | 0.86 | MEN1 (0.43) | CACNA1BPSMB8PSMB5ALDH1A1PSMB9 | |
| SCHEMBL7110901 | 0.86 | MEN1 (0.43) | CACNA1BPSMB8PSMB5ALDH1A1PSMB9 | |
| SCHEMBL7105628 | 0.81 | MEN1 (0.45) | CACNA1BPSMB8PSMB5ALDH1A1PSMB9 | |
| SCHEMBL6363858 | 0.78 | CACNA1B (0.46) | CACNA1BPSMB8PSMB5ALDH1A1PSMB9 |
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-1097929-A1 | AMINO ACID DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT | ONO PHARMACEUTICAL CO., LTD. (JP) | 2001-05-09 | — | — | EP | claimed |