Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 7/20 | 0.41 |
| ▸ | CTSL | P07711 | 3/20 | 0.41 |
| ▸ | CTSS | P25774 | 3/20 | 0.41 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | IL2RA | P01589 | 1/20 | 0.40 |
| ▸ | ALB | P02768 | 1/20 | 0.40 |
| ▸ | IL2 | P60568 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | ACE | P12821 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | PREP | P48147 | 2/20 | 0.38 |
| ▸ | F10 | P00742 | 1/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9002984 | 0.99 | CASP1 (0.41) | CASP1CTSKCTSLCTSSCTSB | |
| SCHEMBL7388341 | 0.93 | CTSK (0.41) | CASP1CTSKCTSLCTSSCTSB | |
| SCHEMBL7393462 | 0.89 | L3MBTL1 (0.38) | CASP1CTSKCTSLCTSSCTSB | |
| Hydrochloric Acid SCHEMBL9003066 | 0.88 | L3MBTL1 (0.38) | CASP1CTSKCTSLCTSSCTSB | |
| SCHEMBL7388356 | 0.88 | IL2RA (0.41) | IL2RAALBIL2F10PRSS1 | |
| SCHEMBL7395266 | 0.87 | CASP1 (0.40) | CASP1CTSKCTSLCTSSCTSB | |
| SCHEMBL7390912 | 0.87 | GAA (0.40) | CTSKCTSLCTSSCTSBIL2RA | |
| Hydrochloric Acid SCHEMBL9002904 | 0.86 | CASP1 (0.39) | CASP1CTSKCTSLCTSSCTSB | |
| SCHEMBL7394950 | 0.86 | KMT2A (0.38) | IL2RAALBIL2ACE | |
| SCHEMBL7392968 | 0.86 | ITGB3 (0.39) | CASP1CTSKCTSLCTSSCTSB |
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 |
|---|---|---|---|---|---|---|---|
| US-5559232-A | ANTICOAGULANTS | HOFFMANN-LA ROCHE INC. (US) | 1996-09-24 | — | — | US | disclosed |
| EP-0641779-A1 | Novel 1-amidinopiperdines and 4-amidinomorpholines as aggregation inhibitions | F. HOFFMANN-LA ROCHE AG (CH) | 1995-03-08 | — | — | EP | disclosed |