Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | PKM | P14618 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | NQO2 | P16083 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19782957 | 1.00 | ALDH1A1 (0.45) | ALDH1A1KDM4EL3MBTL1HPGDPKM | |
| SCHEMBL19783355 | 0.84 | L3MBTL1 (0.50) | ALDH1A1KDM4EL3MBTL1HPGDKMT2A | |
| SCHEMBL30189726 | 0.84 | L3MBTL1 (0.50) | ALDH1A1KDM4EL3MBTL1HPGDKMT2A | |
| SCHEMBL30189804 | 0.75 | HSD17B10 (0.46) | ALDH1A1KDM4EHPGDSMN1; SMN2HSD17B10 | |
| SCHEMBL19783030 | 0.75 | HSD17B10 (0.46) | ALDH1A1KDM4EHPGDSMN1; SMN2HSD17B10 | |
| SCHEMBL30420380 | 0.74 | BACE1 (0.43) | ALDH1A1KDM4EL3MBTL1HPGDPKM | |
| SCHEMBL25942044 | 0.74 | KDM4E (0.43) | ALDH1A1KDM4EL3MBTL1HPGDPKM | |
| SCHEMBL19782407 | 0.74 | CYP3A4 (0.47) | ALDH1A1KDM4EHPGDPKMGAA | |
| SCHEMBL22392664 | 0.74 | BACE1 (0.43) | ALDH1A1KDM4EL3MBTL1HPGDPKM | |
| SCHEMBL9619834 | 0.72 | HSD17B10 (0.55) | ALDH1A1KDM4EL3MBTL1HPGDPKM |
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-109689647-B | Bicyclic heteroaryl substituted compounds | 百时美施贵宝公司 | 2023-01-20 | — | — | CN | disclosed |