Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 5/20 | 0.43 |
| ▸ | CTSK | P43235 | 5/20 | 0.43 |
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.41 |
| ▸ | CXCR3 | P49682 | 2/20 | 0.38 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | GLP1R | P43220 | 3/20 | 0.36 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.36 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7963473 | 0.88 | CTSS (0.45) | CTSSCTSKCA1CA2CAPN1 | |
| SCHEMBL7974856 | 0.87 | CTSK (0.43) | CTSSCTSKCA1CA2CAPN1 | |
| SCHEMBL19543629 | 0.83 | CTSS (0.53) | CTSSCTSKCA1CA2CAPN1 | |
| SCHEMBL7976998 | 0.79 | CTSK (0.49) | CTSSCTSKCA1CA2CAPN1 | |
| SCHEMBL15984731 | 0.78 | CTSS (0.48) | CTSSCTSKCA1CA2CAPN1 | |
| SCHEMBL16627725 | 0.78 | CTSK (0.46) | CTSSCTSKCA1CA2CAPN1 | |
| SCHEMBL17880450 | 0.78 | CTSK (0.46) | CTSSCTSKCA1CA2CAPN1 | |
| SCHEMBL21361055 | 0.78 | CA1 (0.49) | CTSSCTSKCA1CA2CAPN1 | |
| SCHEMBL7700364 | 0.78 | MEN1 (0.51) | CTSSCTSKCA1CA2CAPN1 | |
| SCHEMBL7974820 | 0.78 | MEN1 (0.51) | CTSSCTSKCA1CA2CAPN1 |
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-2001005748-A1 | OLIGOMERIC AMINO ACID DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | MONSANTO COMPANY (US) | 2001-01-25 | — | — | WO | disclosed |