Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | APAF1 | O14727 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 5/20 | 0.42 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | CCR1 | P32246 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13024341 | 0.85 | L3MBTL1 (0.53) | ALDH1A1L3MBTL1CCR1 | |
| SCHEMBL14046018 | 0.84 | L3MBTL1 (0.40) | ALDH1A1L3MBTL1POLBKMT2ACCR1 | |
| SCHEMBL13184058 | 0.82 | CCR1 (0.50) | CCR1 | |
| SCHEMBL2873758 | 0.74 | CCR1 (0.65) | CCR1 | |
| Hydrochloric Acid SCHEMBL2871237 | 0.73 | CCR1 (0.64) | CCR1 | |
| SCHEMBL13066493 | 0.71 | ALDH1A1 (1.00) | ALDH1A1L3MBTL1APAF1PKMPOLB | |
| SCHEMBL4744968 | 0.70 | ALDH1A1 (0.69) | ALDH1A1APAF1PKMPOLBKMT2A | |
| SCHEMBL6015702 | 0.68 | KMT2A (0.46) | ALDH1A1PKMPOLBKMT2AGAA | |
| SCHEMBL17382011 | 0.67 | ALDH1A1 (0.65) | ALDH1A1L3MBTL1APAF1PKMPOLB | |
| SCHEMBL17382015 | 0.67 | ALDH1A1 (0.65) | ALDH1A1APAF1POLBGAA |
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-7842693-B2 | Substituted piperazines | CHEMOCENTRYX, INC. (US) | 2010-11-30 | — | — | US | disclosed |