Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL17150851 | 1.00 | NPC1 (0.40) | NPC1RAB9ASMN1; SMN2HTTMEN1 | |
| SCHEMBL21576151 | 1.00 | NPC1 (0.40) | NPC1RAB9ASMN1; SMN2HTTMEN1 | |
| SCHEMBL20095194 | 0.78 | NPC1 (0.44) | NPC1RAB9ASMN1; SMN2HTTMEN1 | |
| SCHEMBL10262979 | 0.75 | ACHE (0.41) | MEN1KMT2AACHE | |
| SCHEMBL12433390 | 0.75 | ACHE (0.41) | ACHE | |
| SCHEMBL19203254 | 0.74 | PNMT (0.46) | — | |
| SCHEMBL10262328 | 0.74 | ACHE (0.40) | MAOAMAOBACHE | |
| SCHEMBL27919649 | 0.74 | MAOA (0.30) | MAOAMAOB | |
| SCHEMBL15825529 | 0.74 | PNMT (0.46) | — | |
| SCHEMBL7255269 | 0.73 | NPC1 (0.40) | NPC1RAB9ASMN1; SMN2HTTMEN1 |
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-2017133521-A1 | FXR RECEPTOR AGONIST | 山东轩竹医药科技有限公司 | 2017-08-10 | — | — | WO | disclosed |