Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 5/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.36 |
| ▸ | PLG | P00747 | 3/20 | 0.36 |
| ▸ | TACR1 | P25103 | 1/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8955009 | 0.86 | HTT (0.52) | ALDH1A1HTTPKMSMN1; SMN2KMT2A | |
| SCHEMBL8955020 | 0.84 | ALDH1A1 (0.38) | ALDH1A1HTTPKMSMN1; SMN2GAA | |
| SCHEMBL8954656 | 0.76 | AKR1C3 (0.39) | ALDH1A1SMN1; SMN2KMT2AAKR1C3AKR1C1 | |
| SCHEMBL8954946 | 0.76 | F10 (0.45) | LMNAAKR1C3AKR1C1F10 | |
| SCHEMBL9664400 | 0.75 | ALDH1A1 (0.47) | ALDH1A1HTTKAT6APLGF10 | |
| Bicarbonate SCHEMBL9665131 | 0.74 | F10 (0.57) | PLGF10 | |
| SCHEMBL8954816 | 0.74 | F10 (0.39) | ALDH1A1HTTSMN1; SMN2GAAKMT2A | |
| SCHEMBL8954856 | 0.73 | F10 (0.50) | PLGAKR1C3AKR1C1F10 | |
| SCHEMBL9710120 | 0.72 | F10 (0.38) | ALDH1A1HTTSMN1; SMN2KMT2APLG | |
| SCHEMBL8954996 | 0.71 | F10 (0.39) | HTR7F10 |
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 |
|---|---|---|---|---|---|---|---|
| US-5518735-A | ANTICOAGULANTS ADMINISTERED BY MOUTH | PENTAPHARM AG (CH) | 1996-05-21 | — | — | US | disclosed |