Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | WDR5 | P61964 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | THPO | P40225 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13252924 | 0.75 | AR (0.38) | ARNOTUMMEN1KMT2AALDH1A1 | |
| SCHEMBL19085929 | 0.74 | AR (0.39) | ARNOTUMMEN1KMT2AALDH1A1 | |
| SCHEMBL16687894 | 0.71 | AR (0.41) | ARNOTUMMEN1KMT2AALDH1A1 | |
| SCHEMBL16297460 | 0.69 | GAA (0.43) | ARNOTUMMEN1KMT2AALDH1A1 | |
| SCHEMBL2625780 | 0.69 | AR (0.44) | ARNOTUMMEN1KMT2AALDH1A1 | |
| SCHEMBL111786 | 0.69 | MAOA (0.47) | ARNOTUMMAPTSMN1; SMN2THPO | |
| SCHEMBL2625810 | 0.69 | SIGMAR1 (0.42) | ARNOTUMMEN1KMT2AALDH1A1 | |
| SCHEMBL29803269 | 0.69 | MAOA (0.47) | ARNOTUMMAPTSMN1; SMN2THPO | |
| Bromide SCHEMBL4625297 | 0.68 | DRD1 (0.47) | ARNOTUMMAPTSMN1; SMN2THPO | |
| SCHEMBL12656509 | 0.68 | HTR2A (0.55) | ARNOTUMMEN1KMT2AALDH1A1 |
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-2007075895-A2 | HETEROCYCLIC DERIVATIVES AS MODULATORS OF ION CHANNELS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2007-07-05 | — | — | WO | disclosed |