Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 6/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.38 |
| ▸ | TNIK | Q9UKE5 | 2/20 | 0.36 |
| ▸ | PDE2A | O00408 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | MPL | P40238 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20155653 | 0.82 | ALDH1A1 (0.41) | MAPTALDH1A1KDM4EMEN1GAA | |
| SCHEMBL20155147 | 0.81 | SOS1 (0.43) | MAPTALDH1A1KDM4EMEN1GAA | |
| SCHEMBL20155075 | 0.78 | NUDT1 (0.42) | MAPTALDH1A1GAAKMT2ACYP1A2 | |
| SCHEMBL27870354 | 0.76 | GLA (0.40) | MAPTALDH1A1GAAKIF11TSHR | |
| SCHEMBL20155646 | 0.75 | LIPE (0.36) | MAPTALDH1A1KDM4EMEN1GAA | |
| SCHEMBL1662774 | 0.74 | MAPK14 (0.41) | MAPTALDH1A1KDM4EMEN1GAA | |
| SCHEMBL19648758 | 0.74 | KIF11 (0.43) | MAPTALDH1A1KDM4EMEN1GAA | |
| SCHEMBL27853609 | 0.74 | KMT2A (0.48) | MAPTALDH1A1MEN1GAAKMT2A | |
| SCHEMBL31613351 | 0.74 | CRHR1 (0.42) | KIF11CYP1A2TAS2R14PDE2A | |
| SCHEMBL27853586 | 0.72 | OPRM1 (0.43) | MAPTALDH1A1KDM4EMEN1GAA |
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-2018086604-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATIONS THEREOF | 山东罗欣药业集团股份有限公司 | 2018-05-17 | — | — | WO | disclosed |