Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | DHODH | Q02127 | 5/20 | 0.37 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.37 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | KIT | P10721 | 1/20 | 0.35 |
| ▸ | FLT3 | P36888 | 1/20 | 0.35 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.34 |
| ▸ | CDK2 | P24941 | 2/20 | 0.34 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3260789 | 0.80 | NPSR1 (0.45) | ALDH1A1HPGDALOX15MAPTSMN1; SMN2 | |
| SCHEMBL17156379 | 0.78 | DHODH (0.44) | ALDH1A1HPGDALOX15HSD17B10MAPT | |
| SCHEMBL17156309 | 0.77 | DHODH (0.61) | ALDH1A1HPGDALOX15HSD17B10MAPT | |
| SCHEMBL3264182 | 0.74 | KCNN4 (0.39) | ALDH1A1HPGDMAPTDHODHTRPM8 | |
| SCHEMBL3264878 | 0.71 | CYP1A2 (0.40) | SMN1; SMN2RAB9A | |
| SCHEMBL3261172 | 0.71 | ALDH1A1 (0.41) | ALDH1A1HPGDALOX15HSD17B10MAPT | |
| SCHEMBL3263951 | 0.71 | KDM5A (0.43) | ALDH1A1HPGDALOX15HSD17B10MAPT | |
| SCHEMBL16019533 | 0.69 | ALDH1A1 (0.50) | ALDH1A1HPGDALOX15HSD17B10MAPT | |
| SCHEMBL3264381 | 0.69 | TRPM8 (0.43) | ALDH1A1MAPTSMN1; SMN2TDP1DHODH | |
| SCHEMBL17156320 | 0.68 | ALDH1A1 (0.43) | ALDH1A1HPGDALOX15HSD17B10MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2929883-A1 | Pyrazole derivatives as dihydroorotate dehydrogenase (DHODH) inhibitors | INSTITUT PASTEUR (FR) | 2015-10-14 | — | — | EP | disclosed |