Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE7A | Q13946 | 2/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.34 |
| ▸ | GRIN2A | Q12879 | 4/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.33 |
| ▸ | PSEN1 | P49768 | 3/20 | 0.33 |
| ▸ | PSEN2 | P49810 | 3/20 | 0.33 |
| ▸ | APH1B | Q8WW43 | 3/20 | 0.33 |
| ▸ | NCSTN | Q92542 | 3/20 | 0.33 |
| ▸ | APH1A | Q96BI3 | 3/20 | 0.33 |
| ▸ | PSENEN | Q9NZ42 | 3/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21452462 | 0.90 | PDE7A (0.37) | PDE7AGRIN1GRIN2AGRIN2BSLC6A4 | |
| SCHEMBL21451916 | 0.77 | KDM1A (0.38) | PDE7AGRIN1GRIN2AGRIN2BSLC6A4 | |
| SCHEMBL21452460 | 0.75 | GRIN1 (0.45) | PDE7AGRIN1GRIN2AGRIN2BSLC6A4 | |
| SCHEMBL21451904 | 0.74 | HDAC4 (0.48) | PDE7AGRIN1GRIN2AGRIN2BSLC6A4 | |
| SCHEMBL21452484 | 0.74 | HDAC4 (0.36) | — | |
| SCHEMBL21452518 | 0.74 | HDAC4 (0.34) | — | |
| SCHEMBL21451901 | 0.73 | HDAC4 (0.37) | PDE7AGRIN1GRIN2AGRIN2BSLC6A4 | |
| SCHEMBL23490939 | 0.73 | PSEN1 (0.36) | PDE7AGRIN1GRIN2AGRIN2BSLC6A4 | |
| SCHEMBL21451922 | 0.73 | HCRTR1 (0.34) | GRIN1GRIN2AGRIN2BSLC6A4SLC6A3 | |
| SCHEMBL21452575 | 0.72 | TNKS (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019192602-A1 | AROMATIC COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海键合医药科技有限公司 | 2019-10-10 | — | — | WO | disclosed |