Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | NAMPT | P43490 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | NOS1 | P29475 | 1/20 | 0.45 |
| ▸ | HMOX2 | P30519 | 1/20 | 0.45 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | ATP4A | P20648 | 3/20 | 0.44 |
| ▸ | ATP4B | P51164 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL6240032 | 0.83 | RPS6KB2 (0.42) | KMT2AALDH1A1SMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL6236199 | 0.82 | RPS6KB2 (0.41) | KMT2AALDH1A1SMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL6234238 | 0.80 | RPS6KB2 (0.44) | KMT2AALDH1A1SMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL6237806 | 0.79 | CHEK2 (0.40) | KMT2AALDH1A1SMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL6261584 | 0.78 | RPS6KB2 (0.41) | KMT2AALDH1A1SMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL6233813 | 0.74 | RPS6KB2 (0.43) | KMT2AALDH1A1SMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL6237105 | 0.73 | RPS6KB2 (0.49) | KMT2AALDH1A1NPSR1SMN1; SMN2CYP1A2 | |
| SCHEMBL6236517 | 0.73 | CYP2A6 (0.55) | ALDH1A1CYP3A4CYP2C9KDM4E | |
| SCHEMBL6240919 | 0.72 | RPS6KB2 (0.44) | KMT2AALDH1A1SMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL6255922 | 0.72 | HRH3 (0.51) | ALDH1A1CYP1A2 |
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-2005007099-A2 | PKB INHIBITORS AS ANTI-TUMOR AGENTS | IMCLONE SYSTEMS INCORPORATED (US) | 2005-01-27 | — | — | WO | disclosed |