Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | CA7 | P43166 | 2/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.35 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | GNAI3 | P08754 | 3/20 | 0.32 |
| ▸ | GNAO1 | P09471 | 3/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL695332 | 0.81 | KCNH2 (0.42) | EPHX1CA12CA7CA14LMNA | |
| SCHEMBL13116783 | 0.79 | EPHX1 (0.39) | EPHX1CA12CA7CA14LMNA | |
| SCHEMBL14614841 | 0.78 | CA12 (0.56) | CA12CA7CA14LMNACYP3A4 | |
| SCHEMBL13102865 | 0.76 | GNAI3 (0.41) | EPHX1CA12CA7CA14LMNA | |
| SCHEMBL4408237 | 0.75 | WNT3 (0.36) | EPHX1CA12CA7CA14LMNA | |
| Hydrochloric Acid SCHEMBL31722748 | 0.73 | GNAI3 (0.39) | EPHX1CA12CA7CA14LMNA | |
| SCHEMBL20782568 | 0.71 | CA1 (0.60) | EPHX1CA12CA7CA14LMNA | |
| SCHEMBL297676 | 0.71 | EPHX1 (0.43) | EPHX1CA12CA7CA14LMNA | |
| SCHEMBL2884267 | 0.70 | CA1 (0.47) | CA1CCR8WNT3SFRP1CA2 | |
| Hydrochloric Acid SCHEMBL1702819 | 0.70 | EPHX1 (0.41) | EPHX1CA12CA7CA14LMNA |
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-2009067547-A1 | POLO-LIKE KINASE INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-05-28 | — | — | WO | disclosed |