Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 2/20 | 0.40 |
| ▸ | FLT1 | P17948 | 3/20 | 0.38 |
| ▸ | KDR | P35968 | 3/20 | 0.38 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | MGAM | O43451 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | SI | P14410 | 1/20 | 0.35 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22556384 | 0.89 | ABCG2 (0.42) | ABCG2KDM4EALDH1A1CYP1A2POLB | |
| SCHEMBL22556380 | 0.89 | ABCG2 (0.42) | ABCG2KDM4EALDH1A1CYP1A2POLB | |
| SCHEMBL22571381 | 0.89 | ABCG2 (0.42) | ABCG2KDM4EALDH1A1CYP1A2POLB | |
| SCHEMBL22556479 | 0.84 | ABCG2 (0.48) | ABCG2KDM4EALDH1A1CYP1A2POLB | |
| SCHEMBL30463756 | 0.80 | ABCG2 (0.46) | ABCG2KDM4EALDH1A1CYP1A2POLB | |
| SCHEMBL22556411 | 0.80 | ABCG2 (0.46) | ABCG2KDM4EALDH1A1CYP1A2POLB | |
| SCHEMBL22556518 | 0.80 | ABCG2 (0.51) | ABCG2KDM4EALDH1A1CYP1A2POLB | |
| SCHEMBL22556445 | 0.79 | ABCG2 (0.50) | ABCG2KDM4EALDH1A1CYP1A2POLB | |
| SCHEMBL22556414 | 0.79 | ABCG2 (0.53) | ABCG2KDM4EALDH1A1CYP1A2POLB | |
| SCHEMBL22556465 | 0.79 | GSK3B (0.48) | ABCG2KDM4EALDH1A1CYP1A2POLB |
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-2019222431-A9 | OXADIAZOLE COMPOUNDS | VIVACE THERAPEUTICS, INC. (US) | 2020-10-22 | — | — | WO | disclosed |