Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | SCN4A | P35499 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.33 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20049114 | 0.84 | ACHE (0.37) | ALDH1A1CYP3A4TDP1MAPTKMT2A | |
| SCHEMBL21097668 | 0.84 | MAPT (0.48) | ALDH1A1NPC1SCN4ARAB9ASMN1; SMN2 | |
| SCHEMBL20047427 | 0.80 | ALDH1A1 (0.32) | ALDH1A1CYP3A4TDP1MAPTKMT2A | |
| SCHEMBL20049128 | 0.80 | NPC1 (0.41) | ALDH1A1NPC1SCN4ARAB9ASMN1; SMN2 | |
| SCHEMBL20047500 | 0.80 | CRHR1 (0.32) | ALDH1A1NPC1SCN4ARAB9ASMN1; SMN2 | |
| SCHEMBL22672569 | 0.78 | CA12 (0.45) | PKM | |
| SCHEMBL23502557 | 0.77 | GABRA1 (0.39) | ALDH1A1NPC1SCN4ARAB9ASMN1; SMN2 | |
| SCHEMBL21160893 | 0.77 | RAB9A (0.36) | ALDH1A1NPC1SCN4ARAB9ASMN1; SMN2 | |
| SCHEMBL22255014 | 0.77 | ALDH1A1 (0.39) | ALDH1A1NPC1SCN4ARAB9ASMN1; SMN2 | |
| SCHEMBL13340895 | 0.75 | ALDH1A1 (0.61) | ALDH1A1NPC1RAB9ASMN1; SMN2CYP3A4 |
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-2019118571-A1 | ISOXAZOLE ANALOGS AS FXR AGONISTS AND METHODS OF USE THEREOF | ENANTA PHARMACEUTICALS, INC. (US) | 2019-06-20 | — | — | WO | disclosed |