Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 11/20 | 0.73 |
| ▸ | CTSS | P25774 | 9/20 | 0.73 |
| ▸ | CTSL | P07711 | 7/20 | 0.73 |
| ▸ | CTSB | P07858 | 6/20 | 0.73 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.62 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL6237865 | 0.99 | CTSK (0.71) | CTSKCTSSCTSLCTSBKDM4E | |
| SCHEMBL6238444 | 0.92 | CTSK (0.62) | CTSKCTSSCTSLCTSBKDM4E | |
| SCHEMBL6235821 | 0.89 | CTSS (0.81) | CTSKCTSSCTSLCTSBKDM4E | |
| SCHEMBL6259447 | 0.89 | CTSS (0.81) | CTSKCTSSCTSLCTSBKDM4E | |
| SCHEMBL6241051 | 0.87 | CTSS (0.76) | CTSKCTSSCTSLCTSBKDM4E | |
| SCHEMBL8050135 | 0.86 | NPSR1 (0.65) | CTSKCTSSCTSLCTSBALDH1A1 | |
| SCHEMBL6239841 | 0.85 | CTSS (0.74) | CTSKCTSSCTSLCTSBKDM4E | |
| SCHEMBL6237549 | 0.85 | CTSS (0.73) | CTSKCTSSCTSLCTSBNPSR1 | |
| SCHEMBL6236491 | 0.85 | CTSK (1.00) | CTSKCTSSCTSLCTSBNPSR1 | |
| SCHEMBL6238836 | 0.81 | KDM4E (0.58) | CTSKCTSSCTSLCTSBKDM4E |
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 |