Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | CTSL | P07711 | 11/20 | 0.53 |
| ▸ | CTSS | P25774 | 8/20 | 0.53 |
| ▸ | CTSK | P43235 | 8/20 | 0.53 |
| ▸ | CTSB | P07858 | 6/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6239503 | 0.90 | CTSB (0.57) | KDM4EALDH1A1MAPK1HSD17B10CTSL | |
| SCHEMBL6239326 | 0.81 | CTSK (0.73) | KDM4EALDH1A1MAPK1HSD17B10CTSL | |
| SCHEMBL6237865 | 0.80 | CTSK (0.71) | KDM4EALDH1A1MAPK1HSD17B10CTSL | |
| SCHEMBL6238444 | 0.76 | CTSK (0.62) | KDM4EALDH1A1MAPK1HSD17B10CTSL | |
| SCHEMBL14504385 | 0.76 | MEN1 (0.54) | ALDH1A1CYP1A2SMN1; SMN2 | |
| SCHEMBL6240207 | 0.75 | MAPK1 (0.63) | KDM4EALDH1A1MAPK1HSD17B10CTSL | |
| SCHEMBL6238487 | 0.74 | ALDH1A1 (1.00) | KDM4EALDH1A1MAPK1HSD17B10CTSL | |
| SCHEMBL6236398 | 0.72 | ALDH1A1 (0.94) | KDM4EALDH1A1MAPK1HSD17B10CTSL | |
| SCHEMBL5252246 | 0.71 | ALDH1A1 (0.74) | KDM4EALDH1A1MAPK1HSD17B10CTSL | |
| SCHEMBL5253798 | 0.70 | CTSS (0.48) | KDM4EALDH1A1MAPK1HSD17B10CTSL |
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-2005011703-A1 | 2-CYANO-1,3,5-TRIAZINE-4,6-DIAMINE DERIVATIVES | AKZO NOBEL N.V. (NL) | 2005-02-10 | — | — | WO | disclosed |