Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP10 | Q53GL7 | 5/20 | 0.51 |
| ▸ | PARP11 | Q9NR21 | 5/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.43 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.43 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.43 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 2/20 | 0.41 |
| ▸ | TDP2 | O95551 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 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 | |
|---|---|---|---|---|
| SCHEMBL2275422 | 0.80 | HTR2A (0.50) | PARP10PARP11MEN1MAPTKMT2A | |
| SCHEMBL12151234 | 0.79 | PARP10 (0.53) | PARP10PARP11KDM4EMAPTALDH1A1 | |
| SCHEMBL14402120 | 0.78 | DRD2 (0.45) | PARP10 | |
| SCHEMBL1954116 | 0.78 | HTR2C (0.56) | PARP10PARP11MEN1MAPTKMT2A | |
| SCHEMBL13334411 | 0.75 | HTR2C (0.58) | KDM4EMAPTALDH1A1HPGD | |
| SCHEMBL14360815 | 0.75 | HTR2C (0.66) | — | |
| SCHEMBL5440725 | 0.75 | HTR2C (0.66) | — | |
| SCHEMBL5437363 | 0.75 | HTR2C (0.66) | — | |
| Hydrochloric Acid SCHEMBL5438057 | 0.74 | HTR2C (0.64) | — | |
| Hydrochloric Acid SCHEMBL5445102 | 0.74 | HTR2C (0.64) | — |
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-111961080-B | Oxaspiro phosphine-oxazoline ligand and preparation method and application thereof | 南方科技大学 | 2022-07-29 | — | — | CN | disclosed |
| CN-111961080-A | Oxaspiro phosphine-oxazoline ligand and preparation method and application thereof | 南方科技大学 | 2020-11-20 | — | — | CN | disclosed |