Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 16/20 | 0.43 |
| ▸ | CNR2 | P34972 | 2/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4811918 | 0.94 | CNR1 (0.46) | CNR1CNR2MEN1KMT2A | |
| SCHEMBL4806460 | 0.92 | CNR1 (0.50) | CNR1CNR2 | |
| SCHEMBL4806724 | 0.91 | CNR1 (0.55) | CNR1CNR2 | |
| SCHEMBL14153207 | 0.90 | CNR1 (0.43) | CNR1CNR2MEN1KMT2A | |
| SCHEMBL14153824 | 0.89 | CNR1 (0.54) | CNR1CNR2 | |
| SCHEMBL4812936 | 0.88 | CNR1 (0.45) | CNR1CNR2 | |
| SCHEMBL4801236 | 0.85 | CNR1 (0.43) | CNR1CNR2MEN1KMT2A | |
| SCHEMBL4802735 | 0.85 | CNR1 (0.41) | CNR1CNR2MEN1KMT2A | |
| SCHEMBL4811623 | 0.85 | ALDH1A1 (0.41) | CNR1CNR2IDO1 | |
| SCHEMBL4806021 | 0.85 | CNR1 (0.54) | CNR1CNR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7405221-B2 | Substituted pyrimidines | MERCK & CO., INC. (US) | 2008-07-29 | — | — | US | disclosed |
| EP-1546115-A2 | SUBSTITUTED PYRIMIDINES | Merck & Co., Inc. (US) | 2005-06-29 | — | — | EP | disclosed |
| WO-2004029204-A2 | SUBSTITUTED PYRIMIDINES | MERCK & CO., INC. (US) | 2004-04-08 | — | — | WO | disclosed |