Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 1/20 | 0.45 |
| ▸ | PDE4A | P27815 | 11/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CRHBP | P24387 | 1/20 | 0.31 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL254071 | 0.89 | ROCK2 (0.53) | ROCK2PDE4AALDH1A1TSHRPDE4D | |
| Hydrochloric Acid SCHEMBL29941928 | 0.88 | ROCK2 (0.52) | ROCK2ALDH1A1TSHR | |
| SCHEMBL16046651 | 0.88 | ROCK2 (0.52) | ROCK2ALDH1A1TSHR | |
| SCHEMBL19469296 | 0.85 | ROCK2 (0.50) | ROCK2ALDH1A1TSHRMAPT | |
| SCHEMBL28039785 | 0.84 | ROCK2 (0.52) | ROCK2ALDH1A1TSHR | |
| SCHEMBL12994019 | 0.82 | ROCK2 (0.49) | ROCK2ALDH1A1TSHR | |
| SCHEMBL25339760 | 0.82 | ROCK2 (0.47) | ROCK2PDE4AALDH1A1TSHRPDE4D | |
| SCHEMBL30543684 | 0.82 | ROCK2 (0.47) | ROCK2PDE4AALDH1A1TSHRPDE4D | |
| SCHEMBL17924596 | 0.82 | ROCK2 (0.44) | ROCK2 | |
| SCHEMBL19399231 | 0.81 | ROCK2 (0.50) | ROCK2ALDH1A1TSHRMAPTCRHBP |
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-115181128-A | Phosphine ligand of arylmethyl biaryl and transition metal complex thereof | 东莞市均成高新材料有限公司 | 2022-10-14 | — | — | CN | disclosed |