Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | ALDH1A3 | P47895 | 3/20 | 0.35 |
| ▸ | ALDH1A2 | O94788 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | SMO | Q99835 | 1/20 | 0.35 |
| ▸ | MIF | P14174 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | HIF1AN | Q9NWT6 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL5310853 | 0.85 | DHODH (0.38) | DHODHNPC1RAB9AALDH1A1ALDH1A3 | |
| SCHEMBL5072044 | 0.81 | DHODH (0.50) | DHODHNPC1RAB9AALDH1A1ALDH1A3 | |
| SCHEMBL5252624 | 0.81 | DHODH (0.59) | DHODHNPC1RAB9AALDH1A1ALDH1A3 | |
| SCHEMBL5252652 | 0.81 | DHODH (0.47) | DHODHNPC1RAB9AALDH1A1ALDH1A3 | |
| SCHEMBL5254537 | 0.81 | DHODH (0.40) | DHODHNPC1RAB9AALDH1A1ALDH1A3 | |
| SCHEMBL5252525 | 0.80 | DHODH (0.38) | DHODHNPC1RAB9AALDH1A1ALDH1A3 | |
| SCHEMBL5252808 | 0.80 | DHODH (0.41) | DHODHNPC1RAB9AALDH1A1ALDH1A3 | |
| SCHEMBL5253083 | 0.79 | DHODH (0.64) | DHODHNPC1RAB9AALDH1A1ALDH1A3 | |
| SCHEMBL5248205 | 0.79 | ALDH1A1 (0.40) | DHODHNPC1RAB9AALDH1A1ALDH1A3 | |
| SCHEMBL5248164 | 0.77 | DHODH (0.36) | DHODHNPC1RAB9AALDH1A1ALDH1A3 |
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-1257551-B1 | HETEROCYCLIC COMPOUNDS AND THEIR USE AS PARP INHIBITORS | ABBOTT GMBH & CO KG (DE) | 2007-09-05 | — | — | EP | disclosed |