Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 8/20 | 0.41 |
| ▸ | CTSL | P07711 | 4/20 | 0.41 |
| ▸ | CTSB | P07858 | 4/20 | 0.41 |
| ▸ | CTSH | P09668 | 3/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8703007 | 0.85 | CTSK (0.41) | CTSKCTSLCTSBCTSHNPY5R | |
| SCHEMBL8703004 | 0.85 | CTSK (0.41) | CTSKCTSLCTSBCTSHNPY5R | |
| SCHEMBL12861232 | 0.81 | CHRNB2 (0.33) | — | |
| SCHEMBL12861216 | 0.81 | PIK3CD (0.40) | CTSLCTSBCTSH | |
| SCHEMBL12861355 | 0.81 | GFER (0.39) | CTSKCTSLCTSBCTSHALDH1A1 | |
| SCHEMBL12861229 | 0.80 | KDM4E (0.35) | ALDH1A1 | |
| SCHEMBL12861324 | 0.80 | NCF1 (0.38) | ALDH1A1 | |
| SCHEMBL13155423 | 0.75 | LTA4H (0.47) | CTSKCTSLCTSBCTSHALDH1A1 | |
| SCHEMBL12796577 | 0.75 | SLC6A1 (0.44) | — | |
| SCHEMBL13235676 | 0.74 | CTSK (0.42) | CTSKCTSLCTSBCTSHNPY5R |
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-2017136708-A1 | SYNTHESIS AND COMPOSITION OF RAPAFUCIN LIBRARIES | THE JOHNS HOPKINS UNIVERSITY (US) | 2017-08-10 | — | — | WO | disclosed |