Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | CTSK | P43235 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | CTSL | P07711 | 2/20 | 0.40 |
| ▸ | CTSB | P07858 | 2/20 | 0.40 |
| ▸ | CTSS | P25774 | 2/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5512480 | 0.88 | CHRM2 (0.43) | KMT2ACTSKSMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL5512484 | 0.88 | CHRM2 (0.43) | KMT2ACTSKSMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL5518927 | 0.87 | TDP1 (0.39) | KMT2ACTSKALDH1A1LMNACTSL | |
| SCHEMBL5514819 | 0.87 | FPR2 (0.43) | KMT2ACTSKALDH1A1LMNACTSL | |
| SCHEMBL5519199 | 0.85 | PMP22 (0.42) | KMT2ACTSKSMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL5512832 | 0.84 | CTSK (0.58) | CTSKCTSLCTSBCTSS | |
| SCHEMBL5512829 | 0.84 | CTSK (0.58) | CTSKCTSLCTSBCTSS | |
| SCHEMBL5508656 | 0.84 | CTSK (0.58) | CTSKCTSLCTSBCTSS | |
| SCHEMBL5518535 | 0.84 | CTSK (0.58) | CTSKCTSLCTSBCTSS | |
| Iodide SCHEMBL5526872 | 0.81 | CTSK (0.40) | KMT2ACTSKSMN1; SMN2ALDH1A1LMNA |
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-7279478-B2 | Cathepsin cysteine protease inhibitors | MERCK FROSST CANADA & CO. (CA) | 2007-10-09 | — | — | US | disclosed |