Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 9/20 | 0.57 |
| ▸ | CTSL | P07711 | 7/20 | 0.53 |
| ▸ | CTSS | P25774 | 7/20 | 0.53 |
| ▸ | CTSB | P07858 | 6/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | KYNU | Q16719 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.48 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.48 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.48 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL13058656 | 1.00 | CTSK (0.57) | CTSKCTSLCTSSCTSBALDH1A1 | |
| SCHEMBL16847591 | 0.93 | CTSL (0.62) | CTSKCTSLCTSSCTSBSIRT2 | |
| SCHEMBL8098620 | 0.90 | CTSL (0.55) | CTSKCTSLCTSSCTSBALDH1A1 | |
| SCHEMBL5885617 | 0.90 | CTSK (0.53) | CTSKCTSLCTSSCTSBALDH1A1 | |
| SCHEMBL1701577 | 0.90 | CTSL (0.55) | CTSKCTSLCTSSCTSBALDH1A1 | |
| SCHEMBL12406443 | 0.90 | CTSK (0.56) | CTSKCTSLCTSSCTSBALDH1A1 | |
| SCHEMBL1667005 | 0.89 | CTSK (0.52) | CTSKCTSLCTSSCTSBALDH1A1 | |
| SCHEMBL19017976 | 0.88 | CTSK (0.55) | CTSKCTSLCTSSCTSBALDH1A1 | |
| SCHEMBL3709555 | 0.88 | CTSK (0.55) | CTSKCTSLCTSSCTSBALDH1A1 | |
| SCHEMBL629856 | 0.88 | CTSL (0.67) | CTSKCTSLCTSSCTSBALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1993993-A1 | PROCESSES AND INTERMEDIATES FOR PREPARING STERIC COMPOUNDS | Vertex Pharmaceuticals Incorporated (US) | 2008-11-26 | — | — | EP | disclosed |
| WO-2007109023-A1 | PROCESSES AND INTERMEDIATES FOR PREPARING STERIC COMPOUNDS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2007-09-27 | — | — | WO | disclosed |