Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 4/20 | 0.47 |
| ▸ | NSD3 | Q9BZ95 | 1/20 | 0.46 |
| ▸ | PI4KA | P42356 | 2/20 | 0.46 |
| ▸ | PI4K2B | Q8TCG2 | 2/20 | 0.46 |
| ▸ | PI4K2A | Q9BTU6 | 2/20 | 0.46 |
| ▸ | PI4KB | Q9UBF8 | 2/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9009 | 1.00 | PIK3CD (0.47) | PIK3CDNSD3PI4KAPI4K2BPI4K2A | |
| SCHEMBL130916 | 0.88 | ADORA2A (0.48) | PIK3CDPI4KAPI4K2BPI4K2API4KB | |
| SCHEMBL8903 | 0.87 | ADORA2A (0.49) | PIK3CDNSD3PI4KAPI4K2BPI4K2A | |
| SCHEMBL30013159 | 0.87 | ADORA2A (0.49) | PIK3CDNSD3PI4KAPI4K2BPI4K2A | |
| SCHEMBL8577 | 0.87 | ADORA2A (0.53) | PIK3CDPI4KAPI4K2BPI4K2API4KB | |
| SCHEMBL29651680 | 0.87 | ADORA2A (0.53) | PIK3CDPI4KAPI4K2BPI4K2API4KB | |
| SCHEMBL7930 | 0.86 | ADORA2A (0.48) | PIK3CDNSD3PI4KAPI4K2BPI4K2A | |
| SCHEMBL30670814 | 0.86 | ADORA2A (0.48) | PIK3CDNSD3PI4KAPI4K2BPI4K2A | |
| SCHEMBL21467077 | 0.83 | NSD3 (0.42) | PIK3CDNSD3PI4KAPI4K2BPI4K2A | |
| SCHEMBL8080 | 0.81 | NSD2 (0.44) | PIK3CDNSD3PI4KAPI4K2BPI4K2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-117222413-A | Methods and combinations for treating tumors | 同润生物医药(上海)有限公司 | 2023-12-12 | — | — | CN | claimed |
| CN-117222413-A | Methods and combinations for treating tumors | 同润生物医药(上海)有限公司 | 2023-12-12 | — | — | CN | disclosed |