Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | S1PR1 | P21453 | 7/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.42 |
| ▸ | GPR183 | P32249 | 1/20 | 0.42 |
| ▸ | APLNR | P35414 | 1/20 | 0.42 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.42 |
| ▸ | PYGL | P06737 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.40 |
| ▸ | PDE4A | P27815 | 1/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.40 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL8040180 | 0.84 | S1PR1 (0.58) | ATMKMT2AMEN1S1PR1KDM4E | |
| SCHEMBL8035621 | 0.82 | ATM (0.48) | ATMKMT2AMEN1S1PR1KDM4E | |
| SCHEMBL8037447 | 0.79 | S1PR1 (0.41) | S1PR1KDM4EADRB2GPR183APLNR | |
| SCHEMBL8035722 | 0.78 | RAB9A (0.52) | KMT2AMEN1S1PR1KDM4EMAPK1 | |
| SCHEMBL8037361 | 0.78 | S1PR1 (0.48) | ATMKMT2AMEN1S1PR1KDM4E | |
| SCHEMBL8037438 | 0.78 | S1PR1 (0.45) | S1PR1KDM4EADRB2GPR183APLNR | |
| SCHEMBL8041746 | 0.77 | KMT2A (0.56) | ATMKMT2AMEN1S1PR1L3MBTL1 | |
| SCHEMBL8040252 | 0.76 | ALDH1A1 (0.41) | S1PR1KDM4EPOLBPDE4BMAPT | |
| SCHEMBL8037415 | 0.76 | S1PR1 (0.41) | KMT2AMEN1S1PR1ADRB2GPR183 | |
| SCHEMBL8025554 | 0.75 | MTNR1A (0.42) | S1PR1KDM4E |
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-2009081892-A1 | NOVEL CATECHOL DERIVATIVE, PHARMACEUTICAL COMPOSITION CONTAINING THE SAME, AND USE OF THOSE | KISSEI PHARMACEUTICAL CO., LTD. (JP) | 2009-07-02 | — | — | WO | disclosed |