Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | GLA | P06280 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 9/20 | 0.34 |
| ▸ | VDR | P11473 | 6/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5323891 | 1.00 | KDM4E (0.41) | KDM4EALDH1A1HPGDHSD17B10GLA | |
| SCHEMBL5326367 | 0.79 | VDR (0.37) | KDM4EALDH1A1HSD17B10VDR | |
| SCHEMBL5323899 | 0.79 | AAK1 (0.37) | VDR | |
| SCHEMBL5325348 | 0.78 | L3MBTL1 (0.43) | KDM4EALDH1A1HPGDHSD17B10GLA | |
| SCHEMBL5323314 | 0.74 | KMT2A (0.44) | KDM4EALDH1A1HPGDHSD17B10GLA | |
| SCHEMBL5327068 | 0.74 | KMT2A (0.44) | KDM4EALDH1A1HPGDHSD17B10GLA | |
| SCHEMBL34472182 | 0.73 | KDM4E (0.33) | KDM4EALDH1A1HPGDHSD17B10GAA | |
| SCHEMBL634310 | 0.67 | ALDH1A1 (0.47) | KDM4EALDH1A1HSD17B10GAAPOLB | |
| SCHEMBL17353507 | 0.66 | ALDH1A1 (0.49) | KDM4EALDH1A1HSD17B10GAAPOLB | |
| SCHEMBL2872256 | 0.66 | ALDH1A1 (0.45) | KDM4EALDH1A1HSD17B10GAAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007121416-A2 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2007-10-25 | — | — | WO | disclosed |
| WO-2007121416-A2 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2007-10-25 | — | — | WO | disclosed |