Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC9A1 | P19634 | 4/20 | 0.40 |
| ▸ | MPO | P05164 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.34 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CRHBP | P24387 | 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 | |
|---|---|---|---|---|
| SCHEMBL861630 | 0.80 | SLC9A1 (0.40) | SLC9A1MPOALDH1A1HPGDHSD17B10 | |
| SCHEMBL16815457 | 0.78 | SLC9A1 (0.39) | SLC9A1MPOCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL10772453 | 0.77 | SLC9A1 (0.38) | SLC9A1MPOALDH1A1KDM4EGLA | |
| SCHEMBL11499176 | 0.75 | SLC9A1 (0.42) | SLC9A1MPOALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL16861288 | 0.75 | SLC9A1 (0.37) | SLC9A1MPOALDH1A1HPGDHSD17B10 | |
| SCHEMBL2494852 | 0.74 | SLC9A1 (0.36) | SLC9A1MPOALDH1A1KDM4EPOLB | |
| SCHEMBL31287918 | 0.74 | SLC9A1 (0.44) | SLC9A1MPOALDH1A1KDM4EPOLB | |
| SCHEMBL13500287 | 0.74 | SLC9A1 (0.39) | SLC9A1MPOALDH1A1POLBMAPT | |
| SCHEMBL2777756 | 0.73 | — | — | |
| SCHEMBL4553490 | 0.73 | MAPK1 (0.44) | ALDH1A1KDM4EHPGDHSD17B10LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2121621-B1 | LXR AND FXR MODULATORS | EXELIXIS PATENT CO LLC (US) | 2014-05-07 | — | — | EP | disclosed |
| EP-2121621-A1 | LXR AND FXR MODULATORS | Exelixis, Inc. (US) | 2009-11-25 | — | — | EP | disclosed |
| WO-2008073825-A1 | LXR AND FXR MODULATORS | EXELIXIS, INC. (US) | 2008-06-19 | — | — | WO | disclosed |