Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | ATM | Q13315 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.50 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6480889 | 0.86 | CYP3A4 (0.64) | NPC1RAB9APOLBALDH1A1MAPT | |
| SCHEMBL28900536 | 0.83 | MCL1 (0.47) | NPC1RAB9APOLBALDH1A1MAPT | |
| SCHEMBL28059356 | 0.82 | ALDH1A1 (0.55) | NPC1RAB9APOLBALDH1A1MAPT | |
| SCHEMBL27678304 | 0.82 | NPC1 (0.53) | NPC1RAB9APOLBALDH1A1MAPT | |
| SCHEMBL27891386 | 0.82 | NPC1 (0.53) | NPC1RAB9APOLBALDH1A1MAPT | |
| SCHEMBL27680141 | 0.82 | AGXT (0.61) | NPC1RAB9APOLBALDH1A1MAPT | |
| SCHEMBL27620749 | 0.82 | NPC1 (0.53) | NPC1RAB9APOLBALDH1A1MAPT | |
| SCHEMBL826938 | 0.82 | ALDH1A1 (0.55) | NPC1RAB9APOLBALDH1A1MAPT | |
| SCHEMBL7048352 | 0.81 | NPC1 (0.57) | NPC1RAB9APOLBALDH1A1MAPT | |
| SCHEMBL5583915 | 0.81 | NPC1 (0.49) | NPC1RAB9APOLBALDH1A1MAPT |
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-1506185-B1 | COMPOUNDS AND THEIR USE AS INHIBITORS OF 5-HT | BIOVITRUM AB (SE) | 2006-05-24 | — | — | EP | claimed |