Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 5/20 | 0.51 |
| ▸ | CTSS | P25774 | 3/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | CTSL | P07711 | 2/20 | 0.44 |
| ▸ | CTSB | P07858 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | PREP | P48147 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.41 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19981634 | 0.86 | CTSK (0.52) | CTSKCTSSCA2CA1CA7 | |
| SCHEMBL5873409 | 0.84 | CA1 (0.46) | CTSKCTSSCA2CA1CA7 | |
| SCHEMBL5873355 | 0.83 | CA1 (0.45) | CTSKCTSSCA2CA1CA7 | |
| SCHEMBL3212854 | 0.80 | CTSK (0.53) | CTSKCTSSCA2CA1CA7 | |
| SCHEMBL14778518 | 0.80 | CTSK (0.53) | CTSKCTSSCA2CA1CA7 | |
| SCHEMBL3212857 | 0.80 | CTSK (0.53) | CTSKCTSSCA2CA1CA7 | |
| SCHEMBL19981824 | 0.80 | CTSK (0.50) | CTSKCTSSCA2CA1CA7 | |
| SCHEMBL19981637 | 0.78 | CTSK (0.48) | CTSKCTSSCA2CA1CA7 | |
| SCHEMBL12652419 | 0.77 | CTSK (0.56) | CTSKCTSSCA2CA1CA7 | |
| SCHEMBL14389814 | 0.77 | CTSK (0.56) | CTSKCTSSCA2CA1CA7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7045360-B2 | Method for analysis of reaction products | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2006-05-16 | — | — | US | disclosed |
| US-20020090728-A1 | Method for analysis of reaction products | PRESIDENT AND FELLOWS OF HARVARD COLLEGE | 2002-07-11 | — | — | US | disclosed |
| WO-2001057526-A1 | METHOD FOR ANALYSIS OF REACTION PRODUCTS | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2001-08-09 | — | — | WO | disclosed |