Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 10/20 | 0.52 |
| ▸ | CTSL | P07711 | 9/20 | 0.52 |
| ▸ | CTSK | P43235 | 8/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.42 |
| ▸ | NSD2 | O96028 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | AXL | P30530 | 1/20 | 0.41 |
| ▸ | FLT3 | P36888 | 1/20 | 0.41 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.41 |
| ▸ | MERTK | Q12866 | 1/20 | 0.41 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3451217 | 0.84 | CTSS (0.52) | CTSSCTSLCTSKCTSBHRH3 | |
| SCHEMBL4141262 | 0.76 | CTSS (0.81) | CTSSCTSLCTSK | |
| SCHEMBL13125019 | 0.72 | FLT3 (0.42) | CTSSCTSLCTSKNPC1TP53 | |
| SCHEMBL3450506 | 0.69 | NSD2 (0.56) | CTSSCTSLCTSKNSD2EHMT2 | |
| SCHEMBL3451071 | 0.69 | CTSL (0.48) | CTSSCTSLCTSKCTSBNSD2 | |
| SCHEMBL16231116 | 0.68 | CTSS (1.00) | CTSSCTSLCTSKTYRO3 | |
| SCHEMBL13125004 | 0.68 | CTSS (0.63) | CTSSCTSLCTSKCTSB | |
| SCHEMBL4138661 | 0.68 | CTSK (0.67) | CTSSCTSLCTSK | |
| SCHEMBL4141268 | 0.68 | CTSS (0.57) | CTSSCTSLCTSKNPC1TP53 | |
| SCHEMBL16231117 | 0.67 | CTSS (1.00) | CTSSCTSLCTSK |
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-2004020441-A1 | HETEREOARYL NITRILE DERIVATIVES | NOVARTIS AG (CH) | 2004-03-11 | — | — | WO | disclosed |