Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 13/20 | 0.52 |
| ▸ | CTSK | P43235 | 12/20 | 0.52 |
| ▸ | CTSL | P07711 | 2/20 | 0.45 |
| ▸ | CTSB | P07858 | 2/20 | 0.45 |
| ▸ | P2RY2 | P41231 | 1/20 | 0.42 |
| ▸ | JAK3 | P52333 | 1/20 | 0.41 |
| ▸ | BTK | Q06187 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20817325 | 0.85 | CTSS (0.56) | CTSSCTSKCTSLCTSB | |
| SCHEMBL20817323 | 0.85 | CTSS (0.56) | CTSSCTSKCTSLCTSB | |
| SCHEMBL7787845 | 0.83 | CTSS (0.52) | CTSSCTSKCTSLCTSBP2RY2 | |
| SCHEMBL3957707 | 0.83 | MEN1 (0.52) | CTSSCTSKP2RY2JAK3BTK | |
| SCHEMBL27923119 | 0.80 | CTSS (0.59) | CTSSCTSKCTSLCTSB | |
| SCHEMBL7945007 | 0.79 | TDP1 (0.46) | CTSSCTSKP2RY2JAK3BTK | |
| SCHEMBL7787879 | 0.79 | CTSK (0.51) | CTSSCTSKCTSLCTSBP2RY2 | |
| SCHEMBL19944850 | 0.78 | CTSS (0.55) | CTSSCTSKCTSLCTSB | |
| SCHEMBL1603288 | 0.78 | CTSS (0.63) | CTSSCTSKCTSLCTSB | |
| SCHEMBL16095226 | 0.78 | CTSS (0.63) | CTSSCTSKCTSLCTSB |
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-6001824-A | Butyryl-tyrosinyl spermine, analogs thereof and methods of preparing and using same | THE TRUSTEES OF COLUMBIA UNIVERSITY (US) | 1999-12-14 | — | — | US | disclosed |
| WO-1996022962-A9 | BUTYRYL-TYROSINYL SPERMINE, ANALOGS THEREOF AND METHODS OF PREPARING AND USING SAME | — | 1996-10-03 | — | — | WO | disclosed |
| WO-1996022962-A1 | BUTYRYL-TYROSINYL SPERMINE, ANALOGS THEREOF AND METHODS OF PREPARING AND USING SAME | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 1996-08-01 | — | — | WO | disclosed |