Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.37 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | COMT | P21964 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PRKDC | P78527 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24405544 | 0.83 | GSK3B (0.40) | PDE10AMAP4K1GSK3BPGRALDH1A1 | |
| SCHEMBL24405354 | 0.78 | GSK3B (0.40) | PDE10AMAP4K1GSK3BPGRHSD17B10 | |
| SCHEMBL24405741 | 0.75 | GLO1 (0.41) | PDE10AMAP4K1GSK3BPGR | |
| SCHEMBL24405829 | 0.73 | PDE10A (0.40) | PDE10AMAP4K1GSK3BPGRSMN1; SMN2 | |
| SCHEMBL23119724 | 0.72 | PDE10A (0.42) | PDE10AGSK3B | |
| SCHEMBL23119664 | 0.70 | BRPF1 (0.39) | PDE10AMAP4K1GSK3BPGRALDH1A1 | |
| SCHEMBL24405727 | 0.69 | NPEPPS (0.39) | GSK3BPGRALDH1A1NPC1MEN1 | |
| SCHEMBL24405682 | 0.68 | PGR (0.36) | PDE10AMAP4K1GSK3BPGRSMN1; SMN2 | |
| SCHEMBL24405558 | 0.68 | PGR (0.43) | PDE10AMAP4K1GSK3BPGRALDH1A1 | |
| SCHEMBL24405700 | 0.68 | NPEPPS (0.42) | GSK3BPGRALDH1A1NPC1RAB9A |
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-3774739-B1 | FUSED CYCLIC UREA DERIVATIVES AS CRHR2 ANTAGONIST | RAQUALIA PHARMA INC (JP) | 2022-05-11 | — | — | EP | disclosed |