Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | GLA | P06280 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.35 |
| ▸ | GAA | P10253 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | CASP1 | P29466 | 2/20 | 0.35 |
| ▸ | CASP7 | P55210 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 4/20 | 0.34 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.34 |
| ▸ | BAZ2A | Q9UIF9 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL6169180 | 0.97 | KDM4E (0.36) | KDM4ETSHRHTTGLAL3MBTL1 | |
| SCHEMBL6178151 | 0.81 | BRS3 (0.36) | KDM4EALDH1A1MAPTPOLBMEN1 | |
| SCHEMBL6169791 | 0.80 | MEN1 (0.35) | KDM4EMAPTHSD17B10ALOX15CTSK | |
| SCHEMBL6179349 | 0.79 | ICMT (0.34) | ALDH1A1MAPTSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6177849 | 0.78 | SCN9A (0.35) | KDM4ETSHRHTTGLAL3MBTL1 | |
| SCHEMBL6180436 | 0.78 | PARP1 (0.41) | L3MBTL1ALDH1A1MAPTHDAC2ADORA2A | |
| SCHEMBL6179839 | 0.78 | HRH3 (0.34) | KDM4EL3MBTL1ALDH1A1GAAMAPT | |
| SCHEMBL6181565 | 0.77 | PARP1 (0.38) | KDM4EALDH1A1GAAHPGDSLC6A2 | |
| SCHEMBL6168308 | 0.76 | CA2 (0.37) | KDM4EALDH1A1LMNA | |
| SCHEMBL6176361 | 0.76 | TSHR (0.40) | KDM4ETSHRALDH1A1MAPTHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1542999-A1 | 1H-PYRAZOLE AND 1H-PYRROLE-AZABICYCLIC COMPOUNDS WITH ALFA-7 NACHR ACTIVITY | Pharmacia & Upjohn Company LLC (US) | 2005-06-22 | — | — | EP | disclosed |
| WO-2004013137-A1 | 1H-PYRAZOLE AND 1H-PYRROLE-AZABICYCLIC COMPOUNDS WITH ALFA-7 NACHR ACTIVITY | PHARMACIA & UPJOHN COMPANY LLC (US) | 2004-02-12 | — | — | WO | disclosed |