Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 16/20 | 0.54 |
| ▸ | NPC1 | O15118 | 5/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | RAB9A | P51151 | 5/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.40 |
| ▸ | KLK1 | P06870 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5245667 | 0.85 | HPGD (0.56) | KDM4EALDH1A1RAB9APKMHPGD | |
| SCHEMBL5249116 | 0.80 | NPC1 (0.50) | KDM4ENPC1ALDH1A1RAB9ALMNA | |
| SCHEMBL5246905 | 0.80 | GRM5 (0.42) | ALDH1A1LMNAHPGDMAPTHDAC6 | |
| SCHEMBL5244404 | 0.80 | P2RX3 (0.45) | ALDH1A1HPGDMAPT | |
| SCHEMBL5244694 | 0.79 | HPGD (0.48) | KDM4EALDH1A1RAB9ALMNAHPGD | |
| SCHEMBL5247706 | 0.79 | HPGD (0.39) | ALDH1A1LMNAHPGDMAPTPOLB | |
| SCHEMBL5244587 | 0.77 | L3MBTL1 (0.45) | ALDH1A1RAB9AHPGDMAPTPOLB | |
| SCHEMBL3106881 | 0.77 | ROCK2 (0.42) | KDM4ENPC1ALDH1A1RAB9ALMNA | |
| SCHEMBL5247403 | 0.77 | LMNA (0.39) | ALDH1A1LMNAHPGD | |
| SCHEMBL5247650 | 0.77 | RAB9A (0.43) | NPC1ALDH1A1RAB9ALMNAHPGD |
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-1867331-A1 | TRIAZOLE DERIVATIVE AND THE USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2007-12-19 | — | — | EP | disclosed |