Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 11/20 | 0.67 |
| ▸ | CTSS | P25774 | 10/20 | 0.67 |
| ▸ | CTSL | P07711 | 9/20 | 0.67 |
| ▸ | CTSB | P07858 | 8/20 | 0.67 |
| ▸ | HTR2A | P28223 | 1/20 | 0.58 |
| ▸ | GBA1 | P04062 | 4/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | KHK | P50053 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6239744 | 0.90 | GBA1 (0.63) | CTSKCTSSCTSLCTSBGBA1 | |
| SCHEMBL6238044 | 0.89 | GBA1 (0.62) | CTSKCTSSCTSLCTSBGBA1 | |
| SCHEMBL6239397 | 0.89 | GBA1 (0.62) | CTSKCTSSCTSLCTSBGBA1 | |
| SCHEMBL6235680 | 0.88 | MAPT (0.57) | CTSKCTSSCTSLCTSBGBA1 | |
| SCHEMBL6238470 | 0.87 | CTSS (0.68) | CTSKCTSSCTSLCTSBGBA1 | |
| SCHEMBL6238645 | 0.86 | GBA1 (0.51) | CTSKCTSSCTSLCTSBHTR2A | |
| SCHEMBL6236367 | 0.84 | CTSK (0.63) | CTSKCTSSCTSLCTSBHTR2A | |
| SCHEMBL6239273 | 0.83 | GBA1 (0.53) | CTSKCTSSCTSLCTSBGBA1 | |
| SCHEMBL6272121 | 0.83 | GBA1 (0.50) | CTSKCTSSCTSLCTSBGBA1 | |
| SCHEMBL6239305 | 0.83 | GBA1 (0.52) | CTSKCTSSCTSLCTSBGBA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005011703-A1 | 2-CYANO-1,3,5-TRIAZINE-4,6-DIAMINE DERIVATIVES | AKZO NOBEL N.V. (NL) | 2005-02-10 | — | — | WO | claimed |
| WO-2005011703-A1 | 2-CYANO-1,3,5-TRIAZINE-4,6-DIAMINE DERIVATIVES | AKZO NOBEL N.V. (NL) | 2005-02-10 | — | — | WO | disclosed |
| WO-2005011703-A1 | 2-CYANO-1,3,5-TRIAZINE-4,6-DIAMINE DERIVATIVES | AKZO NOBEL N.V. (NL) | 2005-02-10 | — | — | WO | disclosed |