Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 10/20 | 0.34 |
| ▸ | IL1B | P01584 | 8/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 4/20 | 0.31 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.30 |
| ▸ | BRD2 | P25440 | 1/20 | 0.30 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.30 |
| ▸ | BRDT | Q58F21 | 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 | |
|---|---|---|---|---|
| SCHEMBL27186233 | 0.82 | KRAS (0.38) | P2RX7IL1B | |
| SCHEMBL27186231 | 0.82 | KRAS (0.38) | P2RX7IL1B | |
| SCHEMBL29168355 | 0.82 | KRAS (0.35) | P2RX7HPGDBRD4ABCB11BRD2 | |
| SCHEMBL29168450 | 0.78 | METAP2 (0.34) | P2RX7SMN1; SMN2BRD4 | |
| SCHEMBL29168383 | 0.75 | KDM4E (0.30) | HPGDKDM4EALDH1A1 | |
| SCHEMBL29168385 | 0.74 | GAA (0.32) | P2RX7IL1BHPGDKDM4EALDH1A1 | |
| SCHEMBL27186134 | 0.72 | BRD9 (0.41) | HPGDKDM4EALDH1A1HSD17B10BRD4 | |
| SCHEMBL29168408 | 0.70 | POLB (0.36) | HPGDKDM4EALDH1A1 | |
| SCHEMBL29168349 | 0.69 | RXFP1 (0.37) | P2RX7IL1BHPGDKDM4EALDH1A1 | |
| SCHEMBL29844397 | 0.69 | BTK (0.41) | BRD4 |
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-117651701-A | Novel substituted bicyclic aza heterocycles as SOS1 inhibitors | 唯久生物技术(苏州)有限公司 | 2024-03-05 | — | — | CN | disclosed |