Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | TGM2 | P21980 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 4/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 3/20 | 0.33 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.32 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.32 |
| ▸ | PDE7B | Q9NP56 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2565557 | 0.87 | TP53 (0.42) | ALDH1A1TSHRMEN1KMT2APOLB | |
| SCHEMBL13258397 | 0.85 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2TSHRTGM2MEN1 | |
| SCHEMBL13257622 | 0.82 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2TSHRTGM2MEN1 | |
| SCHEMBL13258368 | 0.81 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2TSHRTGM2MEN1 | |
| SCHEMBL2569162 | 0.78 | TP53 (0.40) | ALDH1A1TSHRMEN1KMT2APOLB | |
| SCHEMBL13257587 | 0.77 | PDE7A (0.53) | ALDH1A1SMN1; SMN2TSHRTGM2MEN1 | |
| SCHEMBL13258410 | 0.76 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2TGM2MEN1KMT2A | |
| SCHEMBL13257621 | 0.75 | APLNR (0.48) | TSHRL3MBTL1PDE7ALMNA | |
| SCHEMBL13257458 | 0.74 | PDE7A (0.42) | ALDH1A1SMN1; SMN2TGM2MEN1KMT2A | |
| SCHEMBL13258402 | 0.74 | CYP2C19 (0.35) | ALDH1A1SMN1; SMN2TSHRMEN1KMT2A |
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-2010087467-A1 | DELTA-5-DESATURASE INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2010-08-05 | — | — | WO | disclosed |