Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.53 |
| ▸ | HPGD | P15428 | 4/20 | 0.53 |
| ▸ | CA12 | O43570 | 3/20 | 0.53 |
| ▸ | CA9 | Q16790 | 3/20 | 0.53 |
| ▸ | CA1 | P00915 | 2/20 | 0.53 |
| ▸ | CA3 | P07451 | 2/20 | 0.53 |
| ▸ | CA4 | P22748 | 2/20 | 0.53 |
| ▸ | CA6 | P23280 | 2/20 | 0.53 |
| ▸ | CA7 | P43166 | 2/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.53 |
| ▸ | CA5A | P35218 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 3/20 | 0.50 |
| ▸ | GAA | P10253 | 4/20 | 0.48 |
| ▸ | GLA | P06280 | 4/20 | 0.48 |
| ▸ | MAOB | P27338 | 2/20 | 0.48 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL1287554 | 0.88 | CYP2A6 (0.51) | ALDH1A1KDM4EHPGDCA12CA9 | |
| SCHEMBL11714226 | 0.82 | ALDH1A1 (0.53) | ALDH1A1KDM4EHPGDCA12CA9 | |
| SCHEMBL1287488 | 0.80 | ALDH1A1 (0.54) | ALDH1A1KDM4EHPGDCA12CA9 | |
| SCHEMBL16795532 | 0.79 | ALDH1A1 (0.43) | ALDH1A1KDM4EHPGDMAOBMEN1 | |
| SCHEMBL7289069 | 0.79 | ALDH1A1 (0.53) | ALDH1A1KDM4EHPGDCA12CA9 | |
| SCHEMBL17338664 | 0.77 | MAOB (0.61) | CA12CA9CA1CA3CA4 | |
| SCHEMBL31064189 | 0.77 | SLC16A3 (0.57) | ALDH1A1KDM4EHPGDCA12CA9 | |
| SCHEMBL31173762 | 0.76 | MTNR1A (0.52) | ALDH1A1KDM4EHPGDCA12CA9 | |
| SCHEMBL16795658 | 0.76 | CA12 (0.43) | ALDH1A1KDM4EHPGDCA12CA9 | |
| SCHEMBL16795611 | 0.76 | CYP2A6 (0.41) | ALDH1A1KDM4EHPGDMAOBMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012048058-A2 | DEVELOPING POTENT URATE TRANSPORTER INHIBITORS: COMPOUNDS DESIGNED FOR THEIR URICOSURIC ACTION | J-PHARMA CO., LTD. (JP) | 2012-04-12 | — | — | WO | disclosed |