Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 5/20 | 0.43 |
| ▸ | USP7 | Q93009 | 1/20 | 0.41 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6557155 | 0.85 | DHFR (0.54) | DHFRHTT | |
| SCHEMBL6555136 | 0.85 | DHFR (0.50) | DHFR | |
| SCHEMBL6555540 | 0.81 | DHFR (0.49) | DHFRHTT | |
| SCHEMBL7572297 | 0.80 | USP7 (0.44) | DHFRUSP7 | |
| SCHEMBL6555063 | 0.78 | DHFR (0.48) | DHFR | |
| SCHEMBL6866050 | 0.77 | DHFR (0.45) | DHFR | |
| SCHEMBL6556460 | 0.77 | DHFR (0.54) | DHFRHTT | |
| SCHEMBL6555159 | 0.77 | DHFR (0.47) | DHFR | |
| SCHEMBL6556639 | 0.77 | DHFR (0.50) | DHFR | |
| SCHEMBL6555101 | 0.76 | DHFR (0.52) | DHFR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1230224-A1 | SUBSTITUTED 5-BENZYL-2,4-DIAMINOPYRIMIDINES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-08-14 | — | — | EP | disclosed |
| WO-2001032633-A1 | SUBSTITUTED 5-BENZYL-2,4-DIAMINOPYRIMIDINES | BASILEA PHARMACEUTICA AG (CH) | 2001-05-10 | — | — | WO | disclosed |