Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | MMP8 | P22894 | 1/20 | 0.42 |
| ▸ | MMP13 | P45452 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | TUBB4A | P04350 | 5/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6080027 | 0.83 | ALDH1A1 (0.52) | ALDH1A1CYP3A4LMNAHTTL3MBTL1 | |
| SCHEMBL30176234 | 0.82 | PPARG (0.58) | CYP3A4L3MBTL1KMT2ACA1CA2 | |
| SCHEMBL24516467 | 0.79 | ALDH1A1 (0.60) | ALDH1A1CYP3A4LMNAHTTMEN1 | |
| SCHEMBL31347553 | 0.79 | NFKB1 (0.66) | ALDH1A1CYP3A4LMNAHTTL3MBTL1 | |
| SCHEMBL7147299 | 0.79 | NFKB1 (0.66) | ALDH1A1CYP3A4LMNAHTTL3MBTL1 | |
| SCHEMBL12089851 | 0.79 | ALDH1A1 (0.55) | ALDH1A1CYP3A4LMNAHTTL3MBTL1 | |
| SCHEMBL31584486 | 0.77 | ALDH1A1 (0.53) | ALDH1A1CYP3A4LMNAHTTL3MBTL1 | |
| SCHEMBL15677116 | 0.76 | TSHR (0.64) | CYP3A4MEN1KMT2AGAACA2 | |
| SCHEMBL31347527 | 0.75 | GAA (0.49) | ALDH1A1CYP3A4LMNAHTTL3MBTL1 | |
| SCHEMBL9524187 | 0.75 | GAA (0.49) | ALDH1A1CYP3A4LMNAHTTL3MBTL1 |
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-9944612-B2 | 1-phenyl-2-pyridinyl alkyl alcohol derivatives as phosphodiesterase inhibitors | CHIESI FARMACEUTICI S.P.A. (IT) | 2018-04-17 | — | — | US | disclosed |