Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.65 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.42 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL20339461 | 1.00 | SMN1; SMN2 (0.65) | SMN1; SMN2SHMT2NPC1RAB9APOLB | |
| SCHEMBL21794570 | 0.85 | ALDH1A1 (0.61) | SMN1; SMN2NPC1RAB9APOLBKDM4E | |
| SCHEMBL6796096 | 0.83 | HDAC3 (0.47) | SMN1; SMN2NPC1RAB9AALDH1A1GAA | |
| SCHEMBL29902982 | 0.82 | SMN1; SMN2 (0.57) | SMN1; SMN2SHMT2NPC1RAB9APOLB | |
| SCHEMBL20339458 | 0.82 | SMN1; SMN2 (0.57) | SMN1; SMN2SHMT2NPC1RAB9APOLB | |
| SCHEMBL29902997 | 0.82 | SMN1; SMN2 (0.50) | SMN1; SMN2SHMT2NPC1RAB9APOLB | |
| SCHEMBL20339248 | 0.82 | SMN1; SMN2 (0.50) | SMN1; SMN2SHMT2NPC1RAB9APOLB | |
| SCHEMBL469448 | 0.81 | SMN1; SMN2 (0.71) | SMN1; SMN2SHMT2NPC1RAB9AALDH1A1 | |
| SCHEMBL4366763 | 0.78 | GPR35 (0.51) | SMN1; SMN2NPC1RAB9AALDH1A1MAPT | |
| SCHEMBL20339514 | 0.77 | SMN1; SMN2 (0.54) | SMN1; SMN2SHMT2POLBALDH1A1HPGD |
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-110167926-B | Poly-ADP ribose polymerase (PARP) inhibitors | 米托布里奇公司 | 2022-09-13 | — | — | CN | disclosed |