Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K8 | P41279 | 3/20 | 0.49 |
| ▸ | IDH1 | O75874 | 2/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.36 |
| ▸ | PRKDC | P78527 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7572173 | 0.85 | FNTA (0.50) | — | |
| SCHEMBL15134221 | 0.80 | MAP3K8 (0.46) | MAP3K8 | |
| SCHEMBL7572286 | 0.78 | FNTA (0.57) | — | |
| SCHEMBL28748316 | 0.71 | HTT (0.46) | IDH1ABCG2PRKDC | |
| SCHEMBL17295517 | 0.68 | IDH1 (0.43) | MAP3K8IDH1 | |
| SCHEMBL20714811 | 0.67 | HTT (0.50) | IDH1ABCG2 | |
| SCHEMBL26989819 | 0.67 | IDH1 (0.40) | IDH1ABCG2PRKDC | |
| SCHEMBL46652 | 0.67 | — | — | |
| SCHEMBL12117937 | 0.65 | ABCG2 (0.46) | IDH1ABCG2PRKDC | |
| SCHEMBL24896332 | 0.65 | HTT (0.47) | IDH1ABCG2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015181272-A1 | RAB GERANYLGERANYL TRANSFERASE INHIBITORS | LEAD DISCOVERY CENTER GMBH (DE) | 2015-12-03 | — | — | WO | disclosed |
| WO-2015181272-A1 | RAB GERANYLGERANYL TRANSFERASE INHIBITORS | LEAD DISCOVERY CENTER GMBH (DE) | 2015-12-03 | — | — | WO | disclosed |