Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 4/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 4/20 | 0.44 |
| ▸ | BCHE | P06276 | 3/20 | 0.44 |
| ▸ | GCK | P35557 | 1/20 | 0.39 |
| ▸ | AKT1 | P31749 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7303768 | 0.81 | SMN1; SMN2 (0.48) | ARSMN1; SMN2MEN1KMT2ANPC1 | |
| SCHEMBL10879583 | 0.81 | ALDH1A1 (0.46) | ARSMN1; SMN2KMT2AHPGDALDH1A1 | |
| SCHEMBL10882722 | 0.78 | ALDH1A1 (0.44) | MEN1KMT2AALDH1A1GCKSLC6A2 | |
| SCHEMBL24287429 | 0.78 | S1PR2 (0.35) | SMN1; SMN2MEN1KMT2AALDH1A1CYP1A2 | |
| SCHEMBL10883303 | 0.78 | LMNA (0.41) | SMN1; SMN2MEN1KMT2ANPC1TSHR | |
| SCHEMBL24287427 | 0.77 | AR (0.44) | ARSMN1; SMN2HPGDACHEBCHE | |
| SCHEMBL10881078 | 0.77 | MAPT (0.44) | ARSMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL5340839 | 0.76 | NPSR1 (0.59) | ARSMN1; SMN2MEN1KMT2ANPC1 | |
| SCHEMBL7690257 | 0.75 | ALDH1A1 (0.59) | ARSMN1; SMN2MEN1KMT2ANPC1 | |
| SCHEMBL12653055 | 0.75 | HTR2A (0.54) | ARSMN1; SMN2MEN1KMT2ANPC1 |
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-2022076629-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |