Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 4/20 | 0.35 |
| ▸ | TP53 | P04637 | 3/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2476049 | 0.83 | ALDH1A1 (0.37) | ALDH1A1GLATDP1TSHRTP53 | |
| SCHEMBL9235403 | 0.83 | TDP1 (0.50) | ALDH1A1GLATDP1TSHRTP53 | |
| SCHEMBL2058774 | 0.80 | ALDH1A1 (0.35) | ALDH1A1GLATDP1TSHRTP53 | |
| SCHEMBL16709681 | 0.77 | SLC6A4 (0.35) | ALDH1A1GLATDP1TSHRTP53 | |
| SCHEMBL16709774 | 0.77 | CHRM2 (0.44) | ALDH1A1GLATDP1TSHRTP53 | |
| SCHEMBL13078550 | 0.73 | TSHR (0.33) | ALDH1A1GLATDP1TSHRMAPT | |
| SCHEMBL16709765 | 0.72 | TDP1 (0.37) | ALDH1A1GLATDP1TSHRTP53 | |
| SCHEMBL12202055 | 0.72 | ALDH1A1 (0.43) | ALDH1A1GLATDP1TSHRTP53 | |
| SCHEMBL9099230 | 0.71 | TDP1 (0.45) | ALDH1A1GLATDP1TSHRTP53 | |
| SCHEMBL13263920 | 0.71 | ALDH1A1 (0.45) | ALDH1A1GLATDP1TSHRTP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2374794-A1 | CYCLIC AMINE COMPOUNDS | Daiichi Sankyo Company, Limited (JP) | 2011-10-12 | — | — | EP | disclosed |
| WO-2010074088-A1 | CYCLIC AMINE COMPOUNDS | 第一三共株式会社 (JP) | 2010-07-01 | — | — | WO | disclosed |