Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMO | Q99835 | 1/20 | 0.32 |
| ▸ | KIT | P10721 | 3/20 | 0.31 |
| ▸ | PLK1 | P53350 | 1/20 | 0.30 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.30 |
| ▸ | AKT1 | P31749 | 1/20 | 0.30 |
| ▸ | CCR2 | P41597 | 1/20 | 0.30 |
| ▸ | HTR3A | P46098 | 1/20 | 0.30 |
| ▸ | BRD4 | O60885 | 1/20 | 0.30 |
| ▸ | CREBBP | Q92793 | 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL28497081 | 0.85 | RPS6KB1 (0.35) | KITPLK1RPS6KB1AKT1 | |
| SCHEMBL21722246 | 0.81 | KIT (0.32) | KITRPS6KB1AKT1HTR3A | |
| SCHEMBL21722220 | 0.77 | RPS6KB1 (0.34) | KITRPS6KB1AKT1HTR3A | |
| SCHEMBL30834561 | 0.73 | RPS6KB1 (0.33) | KITRPS6KB1AKT1 | |
| SCHEMBL21722224 | 0.73 | KRAS (0.35) | KITRPS6KB1AKT1 | |
| Ammonia Solution, Strong SCHEMBL28501192 | 0.73 | FGFR1 (0.33) | KITRPS6KB1AKT1HTR3A | |
| SCHEMBL30834529 | 0.68 | EPHX2 (0.38) | RPS6KB1AKT1 | |
| SCHEMBL29191268 | 0.68 | EPHX2 (0.38) | RPS6KB1AKT1 | |
| SCHEMBL21733503 | 0.68 | KRAS (0.34) | KITHTR3A | |
| SCHEMBL21722152 | 0.67 | CYP1A2 (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-112119075-A | Fused ring compound | 豪夫迈·罗氏有限公司 | 2020-12-22 | — | — | CN | disclosed |