Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 1/20 | 0.47 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.36 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | ACE | P12821 | 2/20 | 0.33 |
| ▸ | MME | P08473 | 1/20 | 0.33 |
| ▸ | CPA1 | P15085 | 1/20 | 0.33 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.33 |
| ▸ | XIAP | P98170 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | ACACB | O00763 | 1/20 | 0.32 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.32 |
| ▸ | PSMB9 | P28065 | 1/20 | 0.32 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | PREP | P48147 | 1/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.32 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.32 |
| ▸ | FKBP4 | Q02790 | 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 | |
|---|---|---|---|---|
| SCHEMBL7772779 | 0.93 | CACNA1B (0.48) | CACNA1BBIRC2NPY5RDPP4ACE | |
| SCHEMBL7772818 | 0.93 | CACNA1B (0.39) | CACNA1BBIRC2ACACBPSMB8PSMB9 | |
| SCHEMBL7110494 | 0.88 | CACNA1B (0.50) | CACNA1BBIRC2 | |
| SCHEMBL6363858 | 0.87 | CACNA1B (0.46) | CACNA1BPSMB8PSMB9PSMB5 | |
| SCHEMBL7768801 | 0.86 | CACNA1B (0.39) | CACNA1BBIRC2ACACBPSMB8PSMB9 | |
| SCHEMBL7768807 | 0.85 | CACNA1B (0.46) | CACNA1BBIRC2ACEPREP | |
| SCHEMBL7110461 | 0.83 | CACNA1B (0.44) | CACNA1BACE | |
| SCHEMBL7776360 | 0.83 | CACNA1B (0.43) | CACNA1BPSMB8PSMB9PSMB5CTSS | |
| Hydrochloric Acid SCHEMBL7774650 | 0.82 | CACNA1B (0.42) | CACNA1BPSMB8PSMB9PSMB5CTSS | |
| SCHEMBL7768814 | 0.82 | CACNA1B (0.39) | CACNA1BBIRC2ACACBPSMB8PSMB9 |
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 |