Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | HSD17B14 | Q9BPX1 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | MGAM | O43451 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | RARA | P10276 | 1/20 | 0.40 |
| ▸ | RARB | P10826 | 1/20 | 0.40 |
| ▸ | RARG | P13631 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1644188 | 0.89 | CYP2A6 (0.46) | NPC1RAB9AMEN1KMT2AHSD17B14 | |
| SCHEMBL69982 | 0.84 | MGAM (0.58) | TDP1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL264131 | 0.83 | HTT (0.55) | NPC1RAB9AMEN1KMT2AHSD17B14 | |
| SCHEMBL15484343 | 0.83 | MGAM (0.56) | TDP1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL1668204 | 0.80 | TDP1 (0.46) | TDP1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL4302176 | 0.80 | MGAM (0.53) | TDP1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL27960111 | 0.76 | TDP1 (0.49) | TDP1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL30464299 | 0.76 | TDP1 (0.58) | TDP1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL999160 | 0.76 | TDP1 (0.58) | TDP1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL264132 | 0.75 | TDP1 (0.49) | TDP1NPC1RAB9AMEN1KMT2A |
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-2019160813-A1 | ISOXAZOLE DERIVATIVES AS FXR AGONISTS AND METHODS OF USE THEREOF | ENANTA PHARMACEUTICALS, INC. (US) | 2019-08-22 | — | — | WO | disclosed |