Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | DRD5 | P21918 | 4/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | KDM1A | O60341 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.31 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.31 |
| ▸ | TDP2 | O95551 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL525652 | 0.86 | CYP3A4 (0.45) | PARP1BRD4CYP3A4MAPTALDH1A1 | |
| Hydrochloric Acid SCHEMBL4762831 | 0.84 | PARP1 (0.44) | PARP1BRD4CYP3A4MAPTALDH1A1 | |
| SCHEMBL11045652 | 0.75 | GAA (0.57) | BRD4DRD5CYP3A4MAPTALDH1A1 | |
| SCHEMBL11041542 | 0.75 | BRD4 (0.38) | BRD4DRD5CYP3A4MAPTALDH1A1 | |
| SCHEMBL19038489 | 0.69 | GAA (0.58) | PARP1DRD5MAPTALDH1A1MAPK1 | |
| SCHEMBL10650554 | 0.69 | MAOA (0.45) | BRD4CYP3A4MAPTALDH1A1LMNA | |
| SCHEMBL29561779 | 0.69 | MAOA (0.45) | BRD4CYP3A4MAPTALDH1A1LMNA | |
| SCHEMBL2937347 | 0.66 | LMNA (0.46) | CYP3A4MAPTKDM1ALMNAMAPK1 | |
| SCHEMBL11043204 | 0.66 | BRD4 (0.44) | BRD4DRD5CYP3A4MAPTALDH1A1 | |
| SCHEMBL4807201 | 0.65 | BRD4 (0.40) | BRD4MAPTALDH1A1LMNAMAPK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2089385-A2 | INHIBITORS OF HEPATITIS C VIRUS | Brystol-Myers Squibb Company (US) | 2009-08-19 | — | — | EP | disclosed |
| EP-2086967-A2 | INHIBITORS OF HEPATITIS C VIRUS | Brystol-Myers Squibb Company (US) | 2009-08-12 | — | — | EP | disclosed |
| WO-2008057871-A2 | INHIBITORS OF HEPATITIS C VIRUS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-05-15 | — | — | WO | disclosed |
| WO-2008057873-A2 | INHIBITORS OF HEPATITIS C VIRUS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-05-15 | — | — | WO | disclosed |