Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 9/20 | 0.50 |
| ▸ | CTSB | P07858 | 7/20 | 0.48 |
| ▸ | CTSS | P25774 | 4/20 | 0.43 |
| ▸ | CTSK | P43235 | 3/20 | 0.43 |
| ▸ | CTSH | P09668 | 2/20 | 0.43 |
| ▸ | CTSC | P53634 | 2/20 | 0.43 |
| ▸ | MASP2 | O00187 | 1/20 | 0.41 |
| ▸ | F2 | P00734 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | ACACB | O00763 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7354030 | 0.84 | CTSL (0.59) | CTSLCTSBCTSSCTSKCTSH | |
| SCHEMBL7400378 | 0.83 | CTSL (0.70) | CTSLCTSBCTSSCTSKCTSH | |
| SCHEMBL7400382 | 0.83 | CTSL (0.70) | CTSLCTSBCTSSCTSKCTSH | |
| SCHEMBL7400374 | 0.83 | CTSL (0.70) | CTSLCTSBCTSSCTSKCTSH | |
| SCHEMBL7399923 | 0.81 | CTSL (0.49) | CTSLCTSBCTSSCTSKCTSH | |
| SCHEMBL7400387 | 0.81 | CTSL (0.38) | CTSLCTSBCTSSCTSKCTSH | |
| SCHEMBL8516640 | 0.79 | CTSL (0.64) | CTSLCTSBCTSSCTSKCTSH | |
| SCHEMBL7411045 | 0.77 | ACACB (0.46) | CTSLCTSBCTSSMASP2F2 | |
| SCHEMBL7595864 | 0.75 | CTSB (0.49) | CTSLCTSBCTSSCTSKCTSH | |
| SCHEMBL7414219 | 0.75 | CTSB (0.49) | CTSLCTSBCTSSCTSKCTSH |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995023222-A1 | IRREVERSIBLE CYSTEINE PROTEASE INHIBITORS CONTAINING VINYL GROUPS CONJUGATED TO ELECTRON WITHDRAWING GROUPS | KHEPRI PHARMACEUTICALS, INC. (US) | 1995-08-31 | — | — | WO | claimed |