Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3A | P49840 | 1/20 | 0.62 |
| ▸ | GSK3B | P49841 | 1/20 | 0.62 |
| ▸ | NPC1 | O15118 | 8/20 | 0.59 |
| ▸ | RAB9A | P51151 | 8/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 3/20 | 0.52 |
| ▸ | PKM | P14618 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | STAT1 | P42224 | 1/20 | 0.51 |
| ▸ | TERT | O14746 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL17695696 | 0.91 | GSK3A (0.61) | GSK3AGSK3BNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL17695679 | 0.91 | GSK3A (0.72) | GSK3AGSK3BNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL17695688 | 0.89 | GSK3B (0.76) | GSK3AGSK3BNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL17695702 | 0.88 | GSK3A (0.71) | GSK3AGSK3BNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL17695681 | 0.86 | GSK3A (0.79) | GSK3AGSK3BNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL17695691 | 0.85 | GSK3A (0.71) | GSK3AGSK3BNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL17695690 | 0.85 | GSK3B (0.81) | GSK3AGSK3BNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL17695686 | 0.83 | GSK3A (0.81) | GSK3AGSK3BNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL17695680 | 0.82 | GSK3B (0.56) | GSK3AGSK3BNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL17695637 | 0.82 | GSK3B (0.76) | GSK3AGSK3BNPC1RAB9ASMN1; SMN2 |
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-2016061344-A1 | GSK3 INHIBITORS AND THEIR USES | MIRX PHARMACEUTICALS LLC (US) | 2016-04-21 | — | — | WO | disclosed |