Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 7/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.44 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.44 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 6/20 | 0.43 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | CLK2 | P49760 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6163513 | 0.82 | CYP3A4 (0.50) | KCNH2CYP3A4POLBCACNA1FMAPK1 | |
| SCHEMBL7463545 | 0.82 | KCNH2 (0.48) | KCNH2CYP3A4POLBCACNA1FMAPK1 | |
| SCHEMBL7468912 | 0.82 | KCNH2 (0.48) | KCNH2CYP3A4POLBCACNA1FMAPK1 | |
| SCHEMBL8324629 | 0.82 | KCNH2 (0.72) | KCNH2POLBCACNA1FMAPK1CACNA1D | |
| SCHEMBL8332205 | 0.82 | KCNH2 (0.72) | KCNH2POLBCACNA1FMAPK1CACNA1D | |
| SCHEMBL8331341 | 0.82 | KCNH2 (0.72) | KCNH2POLBCACNA1FMAPK1CACNA1D | |
| SCHEMBL6959217 | 0.81 | KCNH2 (0.58) | KCNH2CYP3A4POLBCACNA1FMAPK1 | |
| SCHEMBL5619269 | 0.81 | KCNH2 (0.58) | KCNH2CYP3A4POLBCACNA1FMAPK1 | |
| SCHEMBL5619262 | 0.81 | KCNH2 (0.58) | KCNH2CYP3A4POLBCACNA1FMAPK1 | |
| SCHEMBL8544340 | 0.81 | KCNH2 (0.58) | KCNH2CYP3A4POLBCACNA1FMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-10287669-A | — | — | None | — | — | JP | disclosed |
| JP-H10287669-A | SUBSTITUTED AMINOMETHYLPYRROLIDINE DERIVATIVE | DAI ICHI SEIYAKU CO LTD | 1998-10-27 | — | — | JP | disclosed |