Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL6902435 | 0.88 | TDP1 (0.36) | NPC1ALDH1A1RAB9A | |
| SCHEMBL6898596 | 0.88 | NQO2 (0.36) | S1PR1 | |
| SCHEMBL6898578 | 0.87 | ALDH1A1 (0.37) | NPC1ALDH1A1RAB9A | |
| SCHEMBL6901780 | 0.86 | CHRM2 (0.32) | S1PR1 | |
| SCHEMBL6902288 | 0.85 | EDNRB (0.31) | — | |
| SCHEMBL6903706 | 0.85 | ALDH1A1 (0.31) | NPC1ALDH1A1RAB9A | |
| SCHEMBL28572062 | 0.85 | BRD4 (0.32) | S1PR1BRD4CREBBP | |
| SCHEMBL28574931 | 0.85 | BRD4 (0.32) | S1PR1BRD4CREBBP | |
| SCHEMBL6905102 | 0.84 | BRD4 (0.31) | S1PR1BRD4CREBBP | |
| SCHEMBL6903036 | 0.84 | GSK3B (0.33) | BRD4CREBBP |
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 |
|---|---|---|---|---|---|---|---|
| EP-1033371-B1 | Transition metal compound, catalyst system, process for the preparation thereof and its use for the polymerization of olefins | BASELL POLYOLEFINE GMBH (DE) | 2004-01-28 | — | — | EP | claimed |