Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 5/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | MAOA | P21397 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.34 |
| ▸ | HTR1B | P28222 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13799415 | 0.80 | PARP1 (0.51) | PARP1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL4596031 | 0.70 | PARP1 (0.54) | PARP1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL4714383 | 0.69 | PRKAB2 (0.44) | PARP1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL19122972 | 0.68 | PARP1 (0.56) | PARP1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL118317 | 0.68 | LMNA (0.56) | PARP1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL6738820 | 0.68 | LMNA (0.56) | PARP1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL13074639 | 0.68 | PARP1 (0.56) | PARP1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL10264723 | 0.67 | PARP1 (0.55) | PARP1HTR1AMAOAMAOB | |
| SCHEMBL5544997 | 0.66 | MAOA (0.62) | PARP1HTR1AMAOAMAOB | |
| SCHEMBL18474153 | 0.66 | PARP1 (0.54) | PARP1KDM4EALDH1A1HPGDHSD17B10 |
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-1707202-A1 | Organic compounds | Speedel Experimenta AG (CH) | 2006-10-04 | — | — | EP | disclosed |