Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA7 | P43166 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7696439 | 0.85 | ALDH1A1 (0.60) | ALDH1A1CYP2C9CYP2C19GAAKDM4E | |
| SCHEMBL7697114 | 0.76 | EPHX2 (0.54) | ALDH1A1CYP2C9CYP2C19TP53ALOX12 | |
| SCHEMBL7691371 | 0.75 | ALDH1A1 (0.63) | ALDH1A1CYP2C9CYP2C19TP53ALOX12 | |
| SCHEMBL7695170 | 0.75 | ALDH1A1 (0.43) | ALDH1A1CYP2C9CYP2C19TP53ALOX12 | |
| SCHEMBL7688898 | 0.74 | ALDH1A1 (0.45) | ALDH1A1CYP2C9CYP2C19TP53ALOX12 | |
| SCHEMBL7690425 | 0.72 | ALDH1A1 (0.63) | ALDH1A1CYP2C9CYP2C19TP53ALOX12 | |
| SCHEMBL7690235 | 0.71 | ALDH1A1 (0.57) | ALDH1A1TP53ALOX12GAAHTT | |
| SCHEMBL7696433 | 0.70 | ALDH1A1 (0.58) | ALDH1A1CYP2C9CYP2C19TP53ALOX12 | |
| SCHEMBL7689567 | 0.70 | EPHX2 (0.52) | ALDH1A1TP53ALOX12GAAHTT | |
| SCHEMBL7693844 | 0.70 | ALDH1A1 (0.58) | ALDH1A1CYP2C9CYP2C19TP53ALOX12 |
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-2002066443-A2 | 2-THIOXO-1,2,3,4-TETRAHYDROPYRIMIDINE DERIVATIVES | ONO PHARMACEUTICAL CO., LTD. (JP) | 2002-08-29 | — | — | WO | claimed |