Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ANO1 | Q5XXA6 | 3/20 | 0.80 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.69 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.69 |
| ▸ | HTT | P42858 | 1/20 | 0.69 |
| ▸ | MAPT | P10636 | 9/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.68 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.68 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.68 |
| ▸ | HPGD | P15428 | 5/20 | 0.67 |
| ▸ | MEN1 | O00255 | 3/20 | 0.67 |
| ▸ | NPC1 | O15118 | 3/20 | 0.67 |
| ▸ | RAB9A | P51151 | 3/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.67 |
| ▸ | LMNA | P02545 | 1/20 | 0.67 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.67 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.67 |
| ▸ | TP53 | P04637 | 1/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL3924716 | 0.88 | ANO1 (0.77) | ANO1ALDH1A1NPSR1HTTMAPT | |
| SCHEMBL21347817 | 0.87 | ANO1 (0.76) | ANO1ALDH1A1NPSR1HTTMAPT | |
| SCHEMBL8288840 | 0.87 | ANO1 (0.75) | ANO1ALDH1A1NPSR1HTTMAPT | |
| SCHEMBL5370827 | 0.86 | THRB (0.64) | ANO1ALDH1A1NPSR1HTTMAPT | |
| SCHEMBL8290431 | 0.85 | ANO1 (0.72) | ANO1ALDH1A1NPSR1HTTMAPT | |
| SCHEMBL8288843 | 0.84 | ANO1 (0.67) | ANO1ALDH1A1NPSR1HTTMAPT | |
| SCHEMBL3916246 | 0.83 | MAPT (0.78) | ANO1ALDH1A1MAPTKMT2APDE4B | |
| SCHEMBL21347427 | 0.81 | MAPT (1.00) | ANO1ALDH1A1NPSR1HTTMAPT | |
| SCHEMBL21346802 | 0.81 | MAPT (1.00) | ANO1ALDH1A1NPSR1HTTMAPT | |
| SCHEMBL1719520 | 0.80 | ALDH1A1 (1.00) | ANO1ALDH1A1NPSR1HTTMAPT |
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-2005033102-A2 | THIOPHENE-BASED COMPOUNDS EXHIBITING ATP-UTILIZING ENZYME INHIBITORY ACTIVITY, AND COMPOSITIONS, AND USES THEREOF | AMPHORA DISCOVERY CORPORATION (US) | 2005-04-14 | — | — | WO | disclosed |