Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | CFTR | P13569 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 3/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.35 |
| ▸ | ACR | P10323 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 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 | |
|---|---|---|---|---|
| SCHEMBL5031601 | 0.73 | KIF11 (0.44) | KIF11ALDH1A1KDM4ECFTRMEN1 | |
| SCHEMBL30021484 | 0.71 | CFTR (0.49) | ALDH1A1CFTRCES2MEN1KMT2A | |
| SCHEMBL16505901 | 0.71 | CFTR (0.49) | ALDH1A1CFTRCES2MEN1KMT2A | |
| SCHEMBL27823092 | 0.68 | MEN1 (0.66) | KIF11KDM4ECES2PRSS1ACR | |
| SCHEMBL29920925 | 0.68 | MEN1 (0.66) | KIF11KDM4ECES2PRSS1ACR | |
| SCHEMBL4900747 | 0.68 | KIF11 (0.49) | KIF11KDM4ECES2PRSS1ACR | |
| SCHEMBL2635687 | 0.68 | TACR1 (0.42) | ALDH1A1KDM4ECYP2C19MEN1KMT2A | |
| SCHEMBL25277279 | 0.67 | MAPT (0.44) | ALDH1A1KDM4EHPGDCFTRMEN1 | |
| SCHEMBL28471479 | 0.67 | ALDH1A1 (0.53) | KIF11ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL28469639 | 0.67 | KIF11 (0.51) | KIF11ALDH1A1KDM4EHPGDHSD17B10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1904498-A1 | FUSED HETEROCYCLIC DERIVATIVES AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2008-04-02 | — | — | EP | disclosed |
| WO-2007004749-A1 | FUSED HETEROCYCLIC DERIVATIVES AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-01-11 | — | — | WO | disclosed |