Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 5/20 | 0.37 |
| ▸ | PGR | P06401 | 4/20 | 0.37 |
| ▸ | NR3C2 | P08235 | 4/20 | 0.37 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.32 |
| ▸ | PDE2A | O00408 | 1/20 | 0.32 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19440434 | 0.78 | BACE1 (0.32) | SMN1; SMN2TP53MAPTALDH1A1BACE1 | |
| SCHEMBL84653 | 0.76 | LMNA (0.47) | SMN1; SMN2ALDH1A1POLBTUBB1HPGD | |
| SCHEMBL19954972 | 0.74 | KDM4E (0.36) | LOXL2MAPTALDH1A1POLBBACE1 | |
| SCHEMBL19121122 | 0.73 | KIF11 (0.36) | NR3C1PGRNR3C2SMN1; SMN2TP53 | |
| SCHEMBL19120145 | 0.72 | IDH1 (0.35) | LOXL2MAPT | |
| SCHEMBL21524642 | 0.70 | EIF4A3 (0.42) | MAPTALDH1A1 | |
| SCHEMBL18713515 | 0.70 | ALDH1A1 (0.48) | TP53MAPTALDH1A1TUBB1HPGD | |
| SCHEMBL12599317 | 0.70 | LOXL2 (0.42) | LOXL2MAPTALDH1A1 | |
| SCHEMBL19440643 | 0.70 | ALDH1A1 (0.48) | TP53MAPTALDH1A1TUBB1HPGD | |
| SCHEMBL9510535 | 0.69 | TUBB1 (0.44) | TUBB1 |
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-9782408-B2 | Modulators of cystic fibrosis transmembrane conductance regulator | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2017-10-10 | — | — | US | disclosed |