Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 5/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16248305 | 0.76 | PDGFRB (0.40) | PTGDR2ALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL16248037 | 0.75 | HTR2A (0.39) | PTGDR2ALDH1A1HPGDSMN1; SMN2MEN1 | |
| SCHEMBL29416152 | 0.75 | ALDH1A1 (0.43) | PTGDR2ALDH1A1HPGDSMN1; SMN2MEN1 | |
| SCHEMBL2094053 | 0.74 | PDE4A (0.54) | PTGDR2ALDH1A1KMT2AMAPTCYP1A2 | |
| SCHEMBL17450270 | 0.73 | HTR2A (0.37) | PTGDR2ALDH1A1HPGDSMN1; SMN2MEN1 | |
| SCHEMBL27836626 | 0.71 | ALDH1A1 (0.46) | ALDH1A1HPGDMEN1KMT2AMAPT | |
| SCHEMBL17606963 | 0.71 | PDGFRB (0.36) | PTGDR2ALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL22870503 | 0.71 | HTR2C (0.46) | PTGDR2ALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL25705924 | 0.71 | MEN1 (0.59) | PTGDR2ALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL7723674 | 0.69 | ALDH1A1 (0.48) | PTGDR2ALDH1A1SMN1; SMN2MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-110023302-A | 2,4, 5-trisubstituted 1,2, 4-triazolones as DHODH inhibitors | 拜耳股份有限公司 | 2019-07-16 | — | — | CN | disclosed |