Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | KCNN4 | O15554 | 5/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.36 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.35 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1315351 | 1.00 | MEN1 (0.46) | MEN1KMT2AKCNN4AKR1C3AKR1C2 | |
| SCHEMBL304619 | 1.00 | MEN1 (0.46) | MEN1KMT2AKCNN4AKR1C3AKR1C2 | |
| SCHEMBL305198 | 1.00 | MEN1 (0.46) | MEN1KMT2AKCNN4AKR1C3AKR1C2 | |
| SCHEMBL6673967 | 0.69 | KDM4E (0.41) | ALDH1A1GAAALOX5MTORL3MBTL1 | |
| SCHEMBL1316741 | 0.69 | GAA (0.38) | MEN1KMT2AKCNN4ALDH1A1GAA | |
| SCHEMBL1316739 | 0.69 | GAA (0.38) | MEN1KMT2AKCNN4ALDH1A1GAA | |
| SCHEMBL2089215 | 0.67 | CYP1A2 (0.52) | KMT2AKCNN4ALDH1A1OPRK1 | |
| SCHEMBL30501782 | 0.67 | KCNN4 (0.50) | KMT2AKCNN4AKR1C3AKR1C2KCNE1 | |
| SCHEMBL1239901 | 0.67 | KCNN4 (0.50) | KMT2AKCNN4AKR1C3AKR1C2KCNE1 | |
| SCHEMBL23357274 | 0.66 | CYP2D6 (0.44) | KMT2AALDH1A1ALOX5 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011075439-A1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2011-06-23 | — | — | WO | disclosed |
| WO-2011059850-A1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2011-05-19 | — | — | WO | disclosed |
| WO-2011059887-A1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2011-05-19 | — | — | WO | disclosed |