Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.58 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL15177556 | 0.86 | ALDH1A1 (0.56) | ALDH1A1LMNAHPGDMEN1KMT2A | |
| SCHEMBL3919293 | 0.85 | TSHR (0.47) | ALDH1A1LMNAHPGDMAPTSMN1; SMN2 | |
| SCHEMBL12587434 | 0.84 | HSD11B1 (0.63) | ALDH1A1LMNAHSD11B1MEN1KMT2A | |
| SCHEMBL12188938 | 0.80 | ALDH1A1 (0.70) | ALDH1A1LMNAL3MBTL1THRBHSD11B1 | |
| SCHEMBL12509539 | 0.80 | NAMPT (0.53) | ALDH1A1LMNAL3MBTL1THRBSMN1; SMN2 | |
| SCHEMBL12189232 | 0.79 | ALDH1A1 (0.72) | ALDH1A1LMNAL3MBTL1THRBHSD11B1 | |
| SCHEMBL15215001 | 0.77 | ALDH1A1 (0.66) | ALDH1A1LMNAL3MBTL1THRBHSD11B1 | |
| SCHEMBL3325328 | 0.77 | KCNH2 (0.76) | — | |
| SCHEMBL14303498 | 0.77 | KCNH2 (0.76) | — | |
| SCHEMBL4480464 | 0.76 | ALDH1A1 (0.63) | ALDH1A1LMNAL3MBTL1THRBHSD11B1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7956052-B2 | Modulators of ATP-binding cassette transporters | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2011-06-07 | — | — | US | disclosed |