Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN3 | Q9UGI6 | 1/20 | 0.35 |
| ▸ | GCGR | P47871 | 2/20 | 0.34 |
| ▸ | BCHE | P06276 | 2/20 | 0.33 |
| ▸ | ACHE | P22303 | 2/20 | 0.33 |
| ▸ | BACE1 | P56817 | 2/20 | 0.33 |
| ▸ | LIPE | Q05469 | 6/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | AVPR1B | P47901 | 1/20 | 0.32 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.31 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.31 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.31 |
| ▸ | IDH1 | O75874 | 2/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6478087 | 0.87 | GCGR (0.36) | KCNN3GCGRLIPEMCHR1IDH1 | |
| SCHEMBL6478274 | 0.86 | PAX8 (0.37) | KCNN3GCGRLIPEPAX8 | |
| SCHEMBL4849155 | 0.85 | SMPD3 (0.38) | KCNN3GCGRLIPEIDH1 | |
| SCHEMBL14254709 | 0.84 | GRM2 (0.37) | KCNN3LIPECYP3A4HCRTR1HCRTR2 | |
| SCHEMBL6477360 | 0.83 | GCGR (0.35) | KCNN3GCGRLIPEIDH1 | |
| SCHEMBL4845087 | 0.82 | GCGR (0.36) | GCGRLIPEIDH1 | |
| SCHEMBL6478251 | 0.82 | LIPE (0.37) | KCNN3GCGRLIPEMCHR1IDH1 | |
| SCHEMBL4848707 | 0.82 | KCNN3 (0.36) | KCNN3GCGRLIPECYP3A4HCRTR1 | |
| SCHEMBL14254710 | 0.82 | KCNN3 (0.36) | KCNN3GCGRLIPECYP3A4HCRTR1 | |
| SCHEMBL4845117 | 0.82 | KCNN3 (0.36) | KCNN3GCGRLIPECYP3A4HCRTR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6897225-B1 | Inhibitors of αLβ2 mediated cell adhesion | TANABE SEIYAKU CO., LTD. (JP) | 2005-05-24 | — | — | US | disclosed |