Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.46 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL396053 | 0.93 | SMN1; SMN2 (0.57) | SMN1; SMN2CYP19A1HTTKMT2AMEN1 | |
| SCHEMBL4970698 | 0.85 | SMN1; SMN2 (0.50) | SMN1; SMN2CYP19A1HTTKMT2AMEN1 | |
| SCHEMBL2311747 | 0.81 | HTT (0.65) | SMN1; SMN2HTTKMT2AMEN1CXCR1 | |
| SCHEMBL5455180 | 0.81 | GAA (0.64) | SMN1; SMN2CYP19A1HTTKMT2AMEN1 | |
| SCHEMBL2230525 | 0.79 | KMT2A (0.52) | SMN1; SMN2HTTKMT2AMEN1CXCR1 | |
| SCHEMBL2230530 | 0.79 | KMT2A (0.52) | SMN1; SMN2HTTKMT2AMEN1CXCR1 | |
| SCHEMBL30661616 | 0.79 | KMT2A (0.47) | SMN1; SMN2HTTKMT2AMEN1CXCR1 | |
| SCHEMBL2144447 | 0.79 | KMT2A (0.47) | SMN1; SMN2HTTKMT2AMEN1CXCR1 | |
| SCHEMBL6318886 | 0.77 | LMNA (0.48) | SMN1; SMN2HTTKMT2AMEN1CXCR1 | |
| SCHEMBL1008274 | 0.77 | HTT (0.49) | SMN1; SMN2HTTKMT2AMEN1CXCR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1773816-A2 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | Vertex Pharmaceuticals Incorporated (US) | 2007-04-18 | — | — | EP | disclosed |
| WO-2006002421-A2 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2006-01-05 | — | — | WO | disclosed |