Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CCR2 | P41597 | 1/20 | 0.46 |
| ▸ | CCR5 | P51681 | 1/20 | 0.46 |
| ▸ | KDM1A | O60341 | 1/20 | 0.45 |
| ▸ | RORC | P51449 | 1/20 | 0.44 |
| ▸ | RORB | Q92753 | 1/20 | 0.44 |
| ▸ | KIF11 | P52732 | 1/20 | 0.44 |
| ▸ | IKBKB | O14920 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.43 |
| ▸ | PTPN5 | P54829 | 2/20 | 0.42 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.41 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.41 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13906331 | 0.84 | KIF11 (0.50) | KIF11KDM4ENPC1ALDH1A1CYP1A2 | |
| SCHEMBL26375437 | 0.81 | S1PR1 (0.49) | MAOBKDM1AKIF11IKBKBPGR | |
| SCHEMBL13549883 | 0.79 | ESR2 (0.59) | MAOBMAPTKDM1ARORCRORB | |
| SCHEMBL169007 | 0.79 | PDE2A (0.53) | MAPTSMN1; SMN2TP53CCR2CCR5 | |
| SCHEMBL1263144 | 0.79 | TSHR (0.58) | MAOBKDM1AKIF11PGRASIC3 | |
| SCHEMBL29678302 | 0.79 | TSHR (0.58) | MAOBKDM1AKIF11PGRASIC3 | |
| SCHEMBL1044345 | 0.78 | PTPN5 (0.63) | MAOBMAPTKDM1AKIF11IKBKB | |
| SCHEMBL13778594 | 0.77 | PTPN5 (0.66) | MAOBKDM1AKIF11PGRASIC3 | |
| SCHEMBL26375421 | 0.77 | MAOB (0.47) | MAOBKDM1AKIF11IKBKBPGR | |
| SCHEMBL26827704 | 0.77 | MAOB (0.62) | MAOBKDM1AKIF11PGRASIC3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090275070-A1 | Compounds and Methods of Identifying, Synthesizing, Optimizing and Profiling Protein Modulators | HOUSEY GERARD M | 2009-11-05 | — | — | US | disclosed |
| US-20090275070-A1 | Compounds and Methods of Identifying, Synthesizing, Optimizing and Profiling Protein Modulators | HOUSEY GERARD M | 2009-11-05 | — | — | US | disclosed |