Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | COMT | P21964 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19782751 | 1.00 | MAPT (0.35) | MAPTPKMSMN1; SMN2GAAPOLB | |
| SCHEMBL19776329 | 0.81 | PGK1 (0.40) | MAPTSMN1; SMN2POLBALDH1A1NPSR1 | |
| SCHEMBL19775910 | 0.77 | PKM (0.38) | MAPTPKMGAAPOLBALDH1A1 | |
| SCHEMBL30810784 | 0.76 | ATR (0.36) | MAPTSMN1; SMN2POLBCOMTALDH1A1 | |
| SCHEMBL19776332 | 0.76 | ATR (0.36) | MAPTSMN1; SMN2POLBCOMTALDH1A1 | |
| SCHEMBL19782408 | 0.74 | PKM (0.40) | MAPTPKMSMN1; SMN2GAAPOLB | |
| SCHEMBL19782960 | 0.72 | MAPT (0.33) | MAPTPKMCOMTALDH1A1NPSR1 | |
| SCHEMBL28909886 | 0.72 | LMNA (0.44) | MAPTPKMPOLBALDH1A1HTT | |
| SCHEMBL13401100 | 0.71 | PTGS2 (0.39) | MAPTPKMSMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL29471193 | 0.70 | LMNA (0.45) | MAPTPKMGAAALDH1A1KDM4E |
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 |