Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 4/20 | 0.38 |
| ▸ | CA12 | O43570 | 3/20 | 0.38 |
| ▸ | CA7 | P43166 | 2/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | APLNR | P35414 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | CTSS | P25774 | 3/20 | 0.37 |
| ▸ | CTSK | P43235 | 3/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13449471 | 0.85 | TDP1 (0.49) | TDP1MEN1KMT2AGAAEPHX1 | |
| SCHEMBL4151784 | 0.83 | TDP1 (0.43) | TDP1MEN1KMT2AGAAEPHX1 | |
| SCHEMBL22950318 | 0.83 | TDP1 (0.43) | TDP1MEN1KMT2AGAAEPHX1 | |
| SCHEMBL1233767 | 0.83 | TDP1 (0.43) | TDP1MEN1KMT2AGAAEPHX1 | |
| SCHEMBL19557967 | 0.82 | MEN1 (0.41) | TDP1MEN1KMT2AGAAEPHX1 | |
| SCHEMBL24698537 | 0.82 | EPHX1 (0.41) | TDP1GAAEPHX1ALDH1A1TSHR | |
| SCHEMBL12698678 | 0.82 | TDP1 (0.48) | TDP1MEN1KMT2AGAAEPHX1 | |
| SCHEMBL4202727 | 0.82 | TDP1 (0.48) | TDP1MEN1KMT2AGAAEPHX1 | |
| SCHEMBL843323 | 0.82 | TDP1 (0.48) | TDP1MEN1KMT2AGAAEPHX1 | |
| SCHEMBL31368614 | 0.81 | MEN1 (0.47) | TDP1MEN1KMT2AGAAEPHX1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2400846-B1 | HEPATITIS C VIRUS INHIBITORS | ENANTA PHARM INC (US) | 2016-10-05 | — | — | EP | disclosed |
| EP-2763990-A1 | PYRROLOPYRAZINE KINASE INHIBITORS | F.HOFFMANN-LA ROCHE AG (CH) | 2014-08-13 | — | — | EP | disclosed |
| WO-2013030138-A1 | PYRROLOPYRAZINE KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2013-03-07 | — | — | WO | disclosed |