Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 3/20 | 0.35 |
| ▸ | CTSB | P07858 | 2/20 | 0.35 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | MC4R | P32245 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 1/20 | 0.32 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.32 |
| ▸ | PLIN5 | Q00G26 | 1/20 | 0.32 |
| ▸ | ABHD5 | Q8WTS1 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6565010 | 0.94 | CTSS (0.34) | CTSSCTSBCTSLATMEPHX1 | |
| SCHEMBL6565861 | 0.90 | CTSB (0.36) | CTSSCTSBCTSLATMLMNA | |
| SCHEMBL7434373 | 0.88 | CTSB (0.40) | CTSSCTSBCTSLATMEPHX1 | |
| SCHEMBL6565456 | 0.83 | ACHE (0.38) | CTSSCTSBCTSLATMEPHX1 | |
| SCHEMBL7431174 | 0.81 | LMNA (0.37) | CTSSCTSBCTSLATMEPHX1 | |
| SCHEMBL3898232 | 0.77 | CTSB (0.43) | CTSSCTSBCTSLATMEPHX1 | |
| SCHEMBL7435732 | 0.74 | CTSL (0.41) | CTSSCTSBCTSLCTSK | |
| SCHEMBL3899355 | 0.74 | HPGD (0.42) | CTSSCTSBCTSLEPHX1LMNA | |
| SCHEMBL7435739 | 0.73 | NR1H4 (0.35) | CTSSCTSBCTSLATMCTSK | |
| SCHEMBL6567357 | 0.73 | EPHX2 (0.40) | CTSSCTSBCTSLEPHX1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002100849-A2 | NOVEL NITRILES USEFUL AS REVERSIBLE INHIBITORS OF CYSTEINE PROTEASES | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 2002-12-19 | — | — | WO | claimed |
| WO-2002100849-A2 | NOVEL NITRILES USEFUL AS REVERSIBLE INHIBITORS OF CYSTEINE PROTEASES | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 2002-12-19 | — | — | WO | disclosed |