Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CTSB | P07858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL24298896 | 0.87 | ALDH1A1 (0.45) | ALDH1A1MAPK1L3MBTL1EPHX1MEN1 | |
| SCHEMBL26047547 | 0.82 | ALDH1A1 (0.49) | ALDH1A1MAPK1L3MBTL1MEN1KMT2A | |
| SCHEMBL24235586 | 0.82 | MEN1 (0.53) | ALDH1A1MAPK1L3MBTL1MEN1KMT2A | |
| SCHEMBL27847367 | 0.81 | ALDH1A1 (0.50) | ALDH1A1MAPK1L3MBTL1EPHX1MEN1 | |
| SCHEMBL28222599 | 0.79 | ALDH1A1 (0.48) | ALDH1A1MAPK1L3MBTL1MEN1KMT2A | |
| SCHEMBL13996825 | 0.79 | ALDH1A1 (0.48) | ALDH1A1MAPK1L3MBTL1MEN1KMT2A | |
| SCHEMBL27312654 | 0.79 | FOLH1 (0.49) | ALDH1A1MAPK1L3MBTL1MEN1KMT2A | |
| SCHEMBL24591318 | 0.76 | ALDH1A1 (0.46) | ALDH1A1MAPK1L3MBTL1MEN1KMT2A | |
| SCHEMBL14614908 | 0.75 | ALDH1A1 (0.59) | ALDH1A1MAPK1L3MBTL1MEN1KMT2A | |
| SCHEMBL16333125 | 0.74 | CTRB1 (0.54) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022076620-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |
| WO-2022076622-A2 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |