Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.45 |
| ▸ | F12 | P00748 | 1/20 | 0.41 |
| ▸ | FYN | P06241 | 1/20 | 0.38 |
| ▸ | KDM5A | P29375 | 1/20 | 0.37 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | MARS1 | P56192 | 1/20 | 0.37 |
| ▸ | PLA2G10 | O15496 | 2/20 | 0.37 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | CFTR | P13569 | 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 | |
|---|---|---|---|---|
| SCHEMBL15048615 | 0.81 | PDE10A (0.42) | PDE10AF12HTR2CKDM4EL3MBTL1 | |
| SCHEMBL15048610 | 0.80 | PDE10A (0.44) | PDE10AF12KDM5AKDM5BMEN1 | |
| SCHEMBL15048557 | 0.79 | PLA2G10 (0.51) | F12MARS1PLA2G10NTRK1KDM4E | |
| SCHEMBL15750493 | 0.74 | MARS1 (0.40) | F12MARS1PLA2G10NTRK1KDM4E | |
| SCHEMBL15048623 | 0.72 | F12 (0.42) | PDE10AF12HTR2CMEN1KMT2A | |
| SCHEMBL30499265 | 0.71 | F12 (0.41) | F12KDM5AKDM5BCFTR | |
| SCHEMBL23202364 | 0.69 | PDE10A (0.39) | PDE10AF12KDM5AKDM5BKDM4E | |
| SCHEMBL31096507 | 0.69 | PDE10A (0.39) | PDE10AF12KDM5AKDM5BKDM4E | |
| SCHEMBL31096545 | 0.69 | KDM4E (0.42) | PDE10AF12MEN1KMT2AKDM4E | |
| SCHEMBL23202506 | 0.69 | KDM4E (0.42) | PDE10AF12MEN1KMT2AKDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2526098-B1 | NITROGEN-CONTAINING HETEROARYL DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2018-07-11 | — | — | EP | claimed |
| US-8470820-B2 | Nitrogen-containing heteroaryl derivatives | HOFFMAN-LA ROCHE INC. (US) | 2013-06-25 | — | — | US | claimed |
| EP-2526098-B1 | NITROGEN-CONTAINING HETEROARYL DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2018-07-11 | — | — | EP | disclosed |
| US-8470820-B2 | Nitrogen-containing heteroaryl derivatives | HOFFMAN-LA ROCHE INC. (US) | 2013-06-25 | — | — | US | disclosed |