Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP2 | O95551 | 1/20 | 0.48 |
| ▸ | NSD2 | O96028 | 1/20 | 0.48 |
| ▸ | XDH | P47989 | 1/20 | 0.45 |
| ▸ | DYRK1A | Q13627 | 5/20 | 0.42 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.41 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.39 |
| ▸ | CTSS | P25774 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | ATR | Q13535 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | FYN | P06241 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | CDC25A | P30304 | 1/20 | 0.37 |
| ▸ | CDC25B | P30305 | 1/20 | 0.37 |
| ▸ | CLK2 | P49760 | 1/20 | 0.37 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21801756 | 0.80 | NSD2 (0.51) | NSD2XDHDYRK1APDE10ATRPV3 | |
| SCHEMBL21801799 | 0.80 | NSD2 (0.51) | NSD2XDHDYRK1APDE10ATRPV3 | |
| SCHEMBL21801704 | 0.80 | TDP2 (0.61) | TDP2NSD2MAOAIDO1CDC25A | |
| SCHEMBL21801808 | 0.78 | XDH (0.55) | XDHDYRK1APDE10ATRPV3CTSS | |
| SCHEMBL21801902 | 0.78 | XDH (0.41) | XDHDYRK1APDE10ATRPV3CTSS | |
| SCHEMBL21801739 | 0.75 | TDP2 (0.47) | TDP2NSD2MAOBMAOAIDO1 | |
| SCHEMBL21801793 | 0.73 | NSD2 (0.58) | TDP2NSD2MAOAIDO1CDC25A | |
| SCHEMBL21801763 | 0.72 | NSD2 (0.57) | TDP2NSD2MAOAIDO1CDC25A | |
| SCHEMBL10203124 | 0.68 | XDH (0.52) | XDHDYRK1ATRPV3CTSSCTSK | |
| SCHEMBL12538473 | 0.67 | TRPV3 (0.49) | XDHDYRK1APDE10ATRPV3CTSS |
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-2020055192-A2 | PREPARATION METHOD FOR QUINOLINE-5, 8-DIONE DERIVATIVE WHICH IS TGASE 2 INHIBITOR | 재단법인 대구경북첨단의료산업진흥재단 | 2020-03-19 | — | — | WO | disclosed |