Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | JAK3 | P52333 | 1/20 | 0.41 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | EED | O75530 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL693233 | 0.79 | ROCK1 (0.51) | ROCK1SMN1; SMN2SIGMAR1L3MBTL1JAK2 | |
| SCHEMBL29478502 | 0.79 | ROCK1 (0.51) | ROCK1SMN1; SMN2SIGMAR1L3MBTL1JAK2 | |
| SCHEMBL618870 | 0.74 | OPRM1 (0.48) | ROCK1SMN1; SMN2SIGMAR1L3MBTL1JAK2 | |
| SCHEMBL28160161 | 0.73 | ALDH1A1 (0.52) | ROCK1SMN1; SMN2SIGMAR1L3MBTL1OPRM1 | |
| SCHEMBL28159694 | 0.73 | MAPT (0.52) | ROCK1SMN1; SMN2SIGMAR1L3MBTL1JAK2 | |
| SCHEMBL2201933 | 0.73 | SMN1; SMN2 (0.53) | ROCK1SMN1; SMN2SIGMAR1L3MBTL1OPRM1 | |
| SCHEMBL3145073 | 0.73 | ROCK1 (0.47) | ROCK1SMN1; SMN2SIGMAR1L3MBTL1JAK2 | |
| SCHEMBL11601096 | 0.73 | SMN1; SMN2 (0.49) | ROCK1SMN1; SMN2SIGMAR1L3MBTL1JAK2 | |
| SCHEMBL27737510 | 0.73 | ALDH1A1 (0.50) | SMN1; SMN2L3MBTL1TSHRALDH1A1MAPT | |
| SCHEMBL6796982 | 0.72 | TSHR (0.51) | ROCK1SMN1; SMN2SIGMAR1L3MBTL1JAK2 |
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-115109099-A | Transition metal compound, catalyst composition comprising the same, and ligand thereof | LG化学株式会社 | 2022-09-27 | — | — | CN | disclosed |