Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.40 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1970519 | 1.00 | ATM (0.46) | ATMTDP1PDK1AKR1C3AKR1C2 | |
| SCHEMBL10651256 | 0.86 | TDP1 (0.45) | ATMTDP1PDK1KCNMA1MAPT | |
| SCHEMBL3528402 | 0.84 | ATM (0.49) | ATMTDP1PDK1KCNMA1MAPT | |
| SCHEMBL3528404 | 0.84 | ATM (0.49) | ATMTDP1PDK1KCNMA1MAPT | |
| SCHEMBL2130850 | 0.83 | ALDH1A1 (0.50) | TDP1PDK1AKR1C3AKR1C2MAPT | |
| SCHEMBL16284320 | 0.83 | TSHR (0.53) | TDP1PDK1KCNMA1ALDH1A1 | |
| SCHEMBL17165018 | 0.83 | ALDH1A1 (0.50) | TDP1PDK1AKR1C3AKR1C2MAPT | |
| SCHEMBL3584977 | 0.83 | ALDH1A1 (0.50) | TDP1PDK1AKR1C3AKR1C2MAPT | |
| SCHEMBL3584980 | 0.83 | ALDH1A1 (0.50) | TDP1PDK1AKR1C3AKR1C2MAPT | |
| SCHEMBL12919832 | 0.82 | PDK1 (0.54) | ATMTDP1PDK1KCNMA1MAPT |
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-1856110-B1 | OXYINDOLE DERIVATIVES AS 5HT4 RECEPTOR AGONISTS | PFIZER (US) | 2011-06-22 | — | — | EP | disclosed |