Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8851913 | 0.89 | — | — | |
| SCHEMBL8851207 | 0.87 | DRD3 (0.36) | — | |
| SCHEMBL6973232 | 0.86 | MEN1 (0.37) | GRIN2BMEN1KMT2A | |
| SCHEMBL10863566 | 0.82 | ADH1A (0.35) | GRIN2BMEN1KMT2A | |
| SCHEMBL8852108 | 0.81 | CHRM1 (0.34) | GRIN2B | |
| SCHEMBL8851201 | 0.81 | SIGMAR1 (0.32) | GRIN2B | |
| SCHEMBL6974292 | 0.80 | CHRM2 (0.39) | GRIN2BMEN1KMT2A | |
| SCHEMBL293248 | 0.80 | — | — | |
| SCHEMBL8852338 | 0.79 | DRD3 (0.32) | — | |
| SCHEMBL8851216 | 0.79 | SIGMAR1 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5618814-A | Trisubstituted pyrimido [5,4-d] pyrimidines for modulating multi-drug resistance and pharmaceutical compositions containing these compounds | DR. KARL THOMAE GMBH (DE) | 1997-04-08 | — | — | US | disclosed |
| EP-0645390-A1 | Trisubstituted pyrimido 5,4-d pyrimidines for modulating multidrug resistance, drugs containing these compounds and processes for their preparation | Dr. Karl Thomae GmbH (DE) | 1995-03-29 | — | — | EP | disclosed |