Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCND1 | P24385 | 2/20 | 0.35 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.35 |
| ▸ | CDK2 | P24941 | 2/20 | 0.35 |
| ▸ | CDK6 | Q00534 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | GBA1 | P04062 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 6/20 | 0.33 |
| ▸ | CTSL | P07711 | 6/20 | 0.33 |
| ▸ | CTSS | P25774 | 6/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 4/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | CTSV | O60911 | 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 | |
|---|---|---|---|---|
| SCHEMBL5445284 | 0.80 | CCND1 (0.35) | CCND1CCNE1CDK2CDK6ALDH1A1 | |
| SCHEMBL14565734 | 0.80 | CTSK (0.49) | CTSKCTSLCTSSCTSBCTSV | |
| SCHEMBL14565744 | 0.78 | PKM (0.49) | ALDH1A1MAPK1GAAHPGDTSHR | |
| SCHEMBL7481625 | 0.78 | CTSK (0.39) | CCND1CCNE1CDK2CDK6ALDH1A1 | |
| SCHEMBL7428075 | 0.77 | CTSK (0.43) | CCND1CCNE1CDK2CDK6ALDH1A1 | |
| SCHEMBL14565729 | 0.75 | PKM (0.46) | ALDH1A1GAASMN1; SMN2MEN1KMT2A | |
| SCHEMBL14565751 | 0.75 | TSHR (0.36) | ALDH1A1MAPK1GAACTSKSMN1; SMN2 | |
| SCHEMBL4839956 | 0.75 | CTSK (0.40) | CCND1CCNE1CDK2CDK6ALDH1A1 | |
| SCHEMBL4839973 | 0.74 | CTSK (0.49) | CTSKCTSLCTSSCTSBCTSV | |
| SCHEMBL7428085 | 0.74 | CTSK (0.41) | ALDH1A1MAPK1GAAUSP2CTSK |
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 |
|---|---|---|---|---|---|---|---|
| US-7196099-B2 | Compounds and compositions as cathepsin inhibitors | AVENTIS PHARMACEUTICALS INC. (US) | 2007-03-27 | — | — | US | disclosed |