Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.45 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.40 |
| ▸ | NEK2 | P51955 | 1/20 | 0.40 |
| ▸ | PLK1 | P53350 | 1/20 | 0.40 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.40 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.40 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29594975 | 0.83 | IKBKB (0.48) | HRH3SMN1; SMN2PDE10ANPC1RAB9A | |
| SCHEMBL20321364 | 0.83 | IKBKB (0.48) | HRH3SMN1; SMN2PDE10ANPC1RAB9A | |
| SCHEMBL11942502 | 0.81 | PDE10A (0.41) | SMN1; SMN2PDE10ANPC1RAB9AHSD17B10 | |
| SCHEMBL18532874 | 0.81 | PDE10A (0.41) | SMN1; SMN2PDE10ANPC1RAB9AHSD17B10 | |
| SCHEMBL1161758 | 0.81 | PDE10A (0.41) | SMN1; SMN2PDE10ANPC1RAB9AHSD17B10 | |
| SCHEMBL22860339 | 0.77 | QDPR (0.48) | SMN1; SMN2NPC1RAB9AHSD17B10ALDH1A1 | |
| SCHEMBL20302480 | 0.75 | CHRM4 (0.61) | PDE10AHSD17B10 | |
| SCHEMBL8265489 | 0.75 | BRD4 (0.48) | MAOAMAOBHRH3BRD4SMN1; SMN2 | |
| SCHEMBL95067 | 0.72 | NPC1 (0.55) | SMN1; SMN2PDE10ANPC1RAB9AHSD17B10 | |
| SCHEMBL31276816 | 0.72 | NPC1 (0.55) | SMN1; SMN2PDE10ANPC1RAB9AHSD17B10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9212147-B2 | Dihydroxy aromatic heterocyclic compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2015-12-15 | — | — | US | disclosed |
| US-9212147-B2 | Dihydroxy aromatic heterocyclic compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2015-12-15 | — | — | US | disclosed |