Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTRB1 | P17538 | 2/20 | 0.57 |
| ▸ | IDO1 | P14902 | 2/20 | 0.51 |
| ▸ | TDO2 | P48775 | 1/20 | 0.51 |
| ▸ | CTSL | P07711 | 13/20 | 0.49 |
| ▸ | CTSK | P43235 | 12/20 | 0.49 |
| ▸ | CTSS | P25774 | 8/20 | 0.48 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.46 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.46 |
| ▸ | TACR1 | P25103 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29080074 | 0.76 | IDO1 (0.64) | IDO1TDO2 | |
| SCHEMBL13964643 | 0.75 | IDO1 (0.51) | IDO1TDO2CTSLCTSKCTSS | |
| SCHEMBL6093916 | 0.75 | CTRB1 (0.72) | CTRB1CTSLCTSKCTSSTACR1 | |
| SCHEMBL6093920 | 0.75 | CTRB1 (0.72) | CTRB1CTSLCTSKCTSSTACR1 | |
| SCHEMBL2482903 | 0.75 | CTRB1 (0.76) | CTRB1CTSLCTSKCTSSTACR1 | |
| SCHEMBL2435512 | 0.75 | CTRB1 (0.76) | CTRB1CTSLCTSKCTSSTACR1 | |
| SCHEMBL1051352 | 0.75 | CTRB1 (0.76) | CTRB1CTSLCTSKCTSSTACR1 | |
| SCHEMBL8766141 | 0.74 | IDO1 (0.57) | IDO1TDO2 | |
| SCHEMBL8900969 | 0.73 | CTRB1 (0.74) | CTRB1CTSLCTSKCTSSTACR1 | |
| SCHEMBL18320645 | 0.73 | CTRB1 (0.74) | CTRB1CTSLCTSKCTSSTACR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0793673-A1 | ALPHA-KETOAMIDE DERIVATIVES AS CATHEPSIN L INHIBITOR | Takeda Chemical Industries, Ltd. (JP) | 1997-09-10 | — | — | EP | disclosed |
| WO-1996016079-A2 | ALPHA-KETOAMIDE DERIVATIVES AS CATHEPSIN L INHIBITOR | TAKEDA CHEMICAL INDUSTRIES, LTD (JP) | 1996-05-30 | — | — | WO | disclosed |