Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | MTOR | P42345 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.47 |
| ▸ | TTR | P02766 | 2/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.44 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.44 |
| ▸ | APP | P05067 | 2/20 | 0.42 |
| ▸ | SNCA | P37840 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | STAT3 | P40763 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2604394 | 0.78 | TTR (0.56) | TRPA1NPC1MTORRAB9AEPHX2 | |
| SCHEMBL4351921 | 0.77 | ERBB2 (0.57) | TRPA1NPC1MTORRAB9AEPHX2 | |
| SCHEMBL31613806 | 0.77 | ERBB2 (0.57) | TRPA1NPC1MTORRAB9AEPHX2 | |
| SCHEMBL3797403 | 0.75 | TTR (0.54) | TRPA1NPC1MTORRAB9AEPHX2 | |
| SCHEMBL30542242 | 0.75 | TTR (0.54) | TRPA1NPC1MTORRAB9AEPHX2 | |
| SCHEMBL13585427 | 0.75 | TRPA1 (0.44) | TRPA1NPC1MTORRAB9AEPHX2 | |
| SCHEMBL599045 | 0.75 | DRD2 (0.43) | NPC1RAB9AEPHX2CES1MAPT | |
| SCHEMBL13296048 | 0.74 | GSK3B (0.48) | TRPA1NPC1MTORRAB9AEPHX2 | |
| SCHEMBL11882604 | 0.73 | TTR (0.52) | TRPA1NPC1MTORRAB9AEPHX2 | |
| SCHEMBL18403869 | 0.72 | ALDH1A1 (0.53) | TRPA1CES1MAPTALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007146695-A1 | ACYCLIC OXIMYL HEPATITIS C PROTEASE INHIBITORS | ENANTA PHARMACEUTICALS, INC. (US) | 2007-12-21 | — | — | WO | disclosed |