Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 5/20 | 0.46 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.46 |
| ▸ | NR3C1 | P04150 | 4/20 | 0.34 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.33 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | ABAT | P80404 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMO | Q99835 | 2/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.32 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.32 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.31 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.31 |
| ▸ | TNKS | O95271 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17156326 | 0.88 | DHODH (0.57) | DHODHTMEM97NR3C1NTRK1ADRB3 | |
| SCHEMBL17156198 | 0.88 | DHODH (0.60) | DHODHTMEM97NR3C1ADRB3ADRA1D | |
| SCHEMBL17156273 | 0.84 | DHODH (0.36) | DHODHNPC1RAB9A | |
| SCHEMBL17156124 | 0.83 | DHODH (0.49) | DHODHTMEM97NTRK1ADRB3ADRA1D | |
| SCHEMBL17156330 | 0.82 | HTT (0.39) | DHODHNPC1RAB9A | |
| SCHEMBL17156113 | 0.82 | DHODH (0.40) | DHODHGABRA5NPC1RAB9A | |
| SCHEMBL17156359 | 0.82 | DHODH (0.53) | DHODHTMEM97NR3C1NTRK1ADRB3 | |
| SCHEMBL17156407 | 0.81 | LTA4H (0.38) | DHODHGABRG2GABRB3GABRA5NPC1 | |
| SCHEMBL17156305 | 0.81 | DHODH (0.63) | DHODHTMEM97NTRK1ADRB3ADRA1D | |
| SCHEMBL17156272 | 0.81 | SMO (0.35) | DHODHTMEM97NPC1RAB9ASMO |
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 |