Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD1 | P21728 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL21734395 | 0.96 | DRD1 (0.52) | DRD1ALDH1A1CYP2A6ALDH1A3KDM4E | |
| SCHEMBL2171861 | 0.83 | DRD1 (0.54) | DRD1 | |
| SCHEMBL2174276 | 0.83 | DRD1 (0.65) | DRD1 | |
| SCHEMBL21735756 | 0.82 | DRD1 (0.52) | DRD1ALDH1A1SMN1; SMN2 | |
| SCHEMBL21734354 | 0.82 | DRD1 (0.68) | DRD1CYP2A6 | |
| SCHEMBL21734393 | 0.79 | DRD1 (0.76) | DRD1ALDH1A1CYP2A6 | |
| SCHEMBL21735745 | 0.79 | DRD1 (0.56) | DRD1ALDH1A1SMN1; SMN2 | |
| SCHEMBL21734353 | 0.72 | DRD1 (0.63) | DRD1 | |
| SCHEMBL2352234 | 0.71 | DRD1 (0.56) | DRD1 | |
| SCHEMBL2544893 | 0.70 | DRD1 (0.51) | DRD1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020034476-A1 | POROUS ORGANIC CAGE LIGAND CONTAINING P AND N AND COMPLEX CATALYST AND APPLICATION | 中国科学院大连化学物理研究所 | 2020-02-20 | — | — | WO | disclosed |
| WO-2020034477-A1 | POROUS ORGANIC CAGE LIGAND CONTAINING P AND N, PREPARATION THEREFOR AND USE THEREOF | 中国科学院大连化学物理研究所 | 2020-02-20 | — | — | WO | disclosed |