Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
| ▸ | IDH1 | O75874 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10204337 | 0.90 | IDH1 (0.31) | IDH1 | |
| SCHEMBL501440 | 0.85 | MEN1 (0.31) | GRIN1GRIN2BIDH1 | |
| SCHEMBL14292828 | 0.80 | KDM4E (0.33) | — | |
| SCHEMBL10204275 | 0.75 | KMT2A (0.35) | GRIN1GRIN2B | |
| SCHEMBL10204284 | 0.74 | MAPK1 (0.34) | GRIN1GRIN2B | |
| SCHEMBL10204421 | 0.74 | KMT2A (0.34) | — | |
| SCHEMBL10204419 | 0.73 | P2RX3 (0.38) | — | |
| SCHEMBL6087230 | 0.72 | KMT2A (0.33) | — | |
| SCHEMBL501625 | 0.71 | P2RX3 (0.41) | IDH1 | |
| SCHEMBL501388 | 0.71 | P2RX3 (0.34) | — |
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-2008016522-A2 | HIV REVERSE TRANSCRIPTASE INHIBITORS | GILEAD SCIENCES, INC. (US) | 2008-02-07 | — | — | WO | disclosed |