Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XIAP | P98170 | 6/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.35 |
| ▸ | BIRC2 | Q13490 | 6/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | MLNR | O43193 | 9/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2022959 | 0.86 | XIAP (0.40) | XIAPPARP1PARP2MLNRCYP3A4 | |
| SCHEMBL20317464 | 0.80 | SLC6A3 (0.43) | XIAPSLC6A2SLC6A4KCNH2BIRC2 | |
| SCHEMBL3144417 | 0.74 | MLNR (0.50) | XIAPSLC6A2SLC6A4KCNH2SLC6A3 | |
| SCHEMBL3137966 | 0.74 | MLNR (0.50) | XIAPSLC6A2SLC6A4KCNH2SLC6A3 | |
| SCHEMBL3137952 | 0.74 | MLNR (0.50) | XIAPSLC6A2SLC6A4KCNH2SLC6A3 | |
| SCHEMBL20317594 | 0.73 | SLC6A3 (0.58) | SLC6A2SLC6A4KCNH2SLC6A3MLNR | |
| SCHEMBL4574566 | 0.73 | SIGMAR1 (0.40) | RIPK1MLNRCYP3A4 | |
| SCHEMBL4590115 | 0.73 | SIGMAR1 (0.40) | RIPK1MLNRCYP3A4 | |
| SCHEMBL4590022 | 0.72 | XIAP (0.48) | XIAPMLNRCYP3A4 | |
| SCHEMBL3172097 | 0.72 | KDM4E (0.55) | XIAPMLNR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008134036-A1 | ALPHA-SUBSTITUTED ARYLMETHYL PIPERAZINE PYRAZOLO[1,5-α]PYRIMIDINE AMIDE DERIVATIVES | PANACOS PHARMACEUTICALS, INC. (US) | 2008-11-06 | — | — | WO | disclosed |