Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 6/20 | 0.62 |
| ▸ | DRD4 | P21917 | 6/20 | 0.62 |
| ▸ | DRD3 | P35462 | 6/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.51 |
| ▸ | BCHE | P06276 | 1/20 | 0.51 |
| ▸ | HTR6 | P50406 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | JAK2 | O60674 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | SOS1 | Q07889 | 2/20 | 0.44 |
| ▸ | KRAS | P01116 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | PDE2A | O00408 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL22619089 | 0.90 | DRD2 (0.62) | DRD2DRD4DRD3CYP2D6BCHE | |
| SCHEMBL22619109 | 0.89 | DRD2 (0.66) | DRD2DRD4DRD3CYP2D6BCHE | |
| SCHEMBL22619062 | 0.86 | DRD2 (0.57) | DRD2DRD4DRD3CYP2D6BCHE | |
| SCHEMBL22619078 | 0.86 | DRD2 (0.57) | DRD2DRD4DRD3CYP2D6BCHE | |
| SCHEMBL22608968 | 0.84 | DRD2 (0.60) | DRD2DRD4DRD3CYP2D6BCHE | |
| SCHEMBL22609031 | 0.84 | DRD2 (0.60) | DRD2DRD4DRD3CYP2D6BCHE | |
| SCHEMBL22609017 | 0.83 | DRD2 (0.59) | DRD2DRD4DRD3CYP2D6BCHE | |
| SCHEMBL22619026 | 0.81 | DRD2 (0.87) | DRD2DRD4DRD3CYP2D6BCHE | |
| SCHEMBL22619022 | 0.81 | DRD2 (0.67) | DRD2DRD4DRD3CYP2D6BCHE | |
| SCHEMBL22619235 | 0.81 | DRD2 (0.67) | DRD2DRD4DRD3CYP2D6BCHE |
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 |
|---|---|---|---|---|---|---|---|
| EP-3733670-A1 | TETRAHYDROPYRROLE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND USE THEREOF | Mediconns (Shanghai) Biopharmaceutical Co., Ltd (CN) | 2020-11-04 | — | — | EP | disclosed |