Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 11/20 | 0.47 |
| ▸ | CTSB | P07858 | 3/20 | 0.47 |
| ▸ | CAPN9 | O14815 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CTSL | P07711 | 3/20 | 0.40 |
| ▸ | CTSK | P43235 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CTSH | P09668 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 1/20 | 0.40 |
| ▸ | CTSC | P53634 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7305670 | 0.95 | GAA (0.46) | CAPN1CTSBCAPN9MAPK1GAA | |
| SCHEMBL7298635 | 0.94 | GAA (0.47) | CAPN1CTSBCAPN9MAPK1GAA | |
| SCHEMBL7305468 | 0.81 | CAPN1 (0.73) | CAPN1CTSBCAPN9MAPK1CTSL | |
| SCHEMBL7298531 | 0.81 | CAPN1 (0.73) | CAPN1CTSBCAPN9MAPK1CTSL | |
| SCHEMBL7302467 | 0.79 | CAPN1 (0.44) | CAPN1CTSBCAPN9MAPK1CTSL | |
| SCHEMBL7298800 | 0.79 | CAPN1 (0.44) | CAPN1CTSBCAPN9MAPK1CTSL | |
| SCHEMBL7305128 | 0.78 | CAPN1 (0.75) | CAPN1CTSBCAPN9MAPK1SMN1; SMN2 | |
| SCHEMBL7299342 | 0.77 | TSHR (0.46) | CAPN1CTSBCAPN9MAPK1TSHR | |
| SCHEMBL7299301 | 0.77 | CAPN1 (0.55) | CAPN1CTSBCAPN9MAPK1CTSL | |
| SCHEMBL7300753 | 0.76 | TSHR (0.47) | CAPN1CTSBCAPN9MAPK1GAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5214056-A | Thiol protease inhibitors | JAPAN TOBACCO INC. (JP) | 1993-05-25 | — | — | US | claimed |
| US-5214056-A | Thiol protease inhibitors | JAPAN TOBACCO INC. (JP) | 1993-05-25 | — | — | US | disclosed |
| EP-0460239-A1 | 1,3,2-DIOXATHIOLANE OXIDE DERIVATIVE | Japan Tobacco Inc. (JP) | 1991-12-11 | — | — | EP | disclosed |