Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 6/20 | 0.65 |
| ▸ | PDE3B | Q13370 | 3/20 | 0.48 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.48 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.48 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.48 |
| ▸ | IDO1 | P14902 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | MMP12 | P39900 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | MAP3K8 | P41279 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4596554 | 0.88 | KIF11 (0.68) | KIF11PDE3BPDE3ACYP11B1CYP11B2 | |
| SCHEMBL1396616 | 0.79 | KIF11 (1.00) | KIF11PDE3BPDE3ACYP11B1CYP11B2 | |
| SCHEMBL3306566 | 0.77 | KIF11 (0.69) | KIF11PDE3BPDE3ACYP11B1CYP11B2 | |
| SCHEMBL4889044 | 0.76 | KIF11 (0.68) | KIF11PDE3BPDE3ACYP11B1CYP11B2 | |
| SCHEMBL3312587 | 0.76 | KIF11 (0.72) | KIF11PDE3BPDE3ACYP11B1CYP11B2 | |
| SCHEMBL4897861 | 0.76 | KIF11 (0.72) | KIF11PDE3BPDE3ACYP11B1CYP11B2 | |
| SCHEMBL99208 | 0.75 | MAOA (0.56) | KIF11PDE3BPDE3ACYP11B1CYP11B2 | |
| Trifluoroacetic Acid SCHEMBL526603 | 0.75 | NPC1 (0.71) | KIF11MAPTNPC1MAOAMAOB | |
| SCHEMBL3310995 | 0.75 | KIF11 (0.70) | KIF11PDE3BPDE3ACYP11B1CYP11B2 | |
| SCHEMBL3310186 | 0.75 | KIF11 (0.70) | KIF11PDE3BPDE3ACYP11B1CYP11B2 |
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-1874753-A2 | COMPOUNDS, COMPOSITIONS AND METHODS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-01-09 | — | — | EP | claimed |
| WO-2006113432-A2 | COMPOUNDS, COMPOSITIONS AND METHODS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-10-26 | — | — | WO | claimed |