Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 4/20 | 0.49 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | HTR2B | P41595 | 1/20 | 0.46 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | BRS3 | P32247 | 2/20 | 0.43 |
| ▸ | PNMT | P11086 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.42 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3389927 | 0.90 | SLC6A5 (0.51) | ACHEC5AR1HTR2CHTR2BSLC6A5 | |
| SCHEMBL4949034 | 0.78 | MEN1 (0.53) | ACHESLC6A5KDM4EMEN1NPC1 | |
| SCHEMBL17877207 | 0.77 | BRD4 (0.56) | ACHESLC6A5GABRA1GABRA2 | |
| SCHEMBL10657990 | 0.76 | CHRM3 (0.57) | C5AR1HTR2CDRD2DRD4DRD3 | |
| SCHEMBL4946012 | 0.75 | ACHE (0.51) | ACHESLC6A5BRS3KMT2AGABRA1 | |
| SCHEMBL3390729 | 0.71 | CLPP (0.46) | C5AR1DRD2DRD4DRD3PNMT | |
| SCHEMBL3390126 | 0.71 | CLPP (0.45) | C5AR1DRD2DRD4DRD3PNMT | |
| SCHEMBL3391586 | 0.71 | C5AR1 (0.43) | C5AR1DRD2DRD4DRD3NPC1 | |
| SCHEMBL2952288 | 0.70 | SLC6A5 (0.56) | ACHESLC6A5BRS3PNMTKDM4E | |
| SCHEMBL2469737 | 0.70 | ACHE (0.41) | ACHEC5AR1HTR2CHTR2BSLC6A5 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2929883-A1 | Pyrazole derivatives as dihydroorotate dehydrogenase (DHODH) inhibitors | INSTITUT PASTEUR (FR) | 2015-10-14 | — | — | EP | disclosed |
| WO-2010015657-A2 | NEW ALKOXYPYRAZOLES | INSTITUT PASTEUR (FR) | 2010-02-11 | — | — | WO | disclosed |
| EP-2151433-A1 | Alkoxypyrazoles and the process for their preparation | Institut Pasteur (FR) | 2010-02-10 | — | — | EP | disclosed |
| EP-2151433-A1 | Alkoxypyrazoles and the process for their preparation | Institut Pasteur (FR) | 2010-02-10 | — | — | EP | disclosed |