Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CTSK | P43235 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CTSL | P07711 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.41 |
| ▸ | ACE | P12821 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL13880229 | 0.85 | ALDH1A1 (0.49) | ALDH1A1TDP1MAPK1L3MBTL1CYP3A4 | |
| SCHEMBL14539225 | 0.85 | ALDH1A1 (0.49) | ALDH1A1TDP1MAPK1L3MBTL1CYP3A4 | |
| SCHEMBL27507059 | 0.85 | ALDH1A1 (0.49) | ALDH1A1TDP1MAPK1L3MBTL1CYP3A4 | |
| SCHEMBL13880231 | 0.85 | ALDH1A1 (0.49) | ALDH1A1TDP1MAPK1L3MBTL1CYP3A4 | |
| SCHEMBL13880240 | 0.84 | CA1 (0.48) | ALDH1A1TDP1MAPK1L3MBTL1CYP3A4 | |
| SCHEMBL9752425 | 0.81 | ALDH1A1 (0.51) | ALDH1A1TDP1MAPK1L3MBTL1CYP3A4 | |
| SCHEMBL28293889 | 0.81 | ALDH1A1 (0.55) | ALDH1A1TDP1MAPK1L3MBTL1CYP3A4 | |
| SCHEMBL21560929 | 0.81 | ALDH1A1 (0.55) | ALDH1A1TDP1MAPK1L3MBTL1CYP3A4 | |
| SCHEMBL17563423 | 0.81 | ALDH1A1 (0.55) | ALDH1A1TDP1MAPK1L3MBTL1CYP3A4 | |
| SCHEMBL13880224 | 0.81 | ALDH1A1 (0.47) | ALDH1A1TDP1MAPK1L3MBTL1CYP3A4 |
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-2007016476-A2 | HEPATITIS C SERINE PROTEASE INHIBITORS AND USES THEREFOR | PHENOMIX CORPORATION (US) | 2007-02-08 | — | — | WO | disclosed |