Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | BLM | P54132 | 3/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | THPO | P40225 | 2/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | XDH | P47989 | 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 | |
|---|---|---|---|---|
| SCHEMBL5749285 | 0.81 | ERCC1 (0.56) | HDAC1GAAERCC1ERCC4CA1 | |
| SCHEMBL4583679 | 0.80 | IDO1 (0.53) | IDO1CA1NAMPTKDM4A | |
| SCHEMBL30423117 | 0.79 | MAPT (0.63) | KDM4EMAPTHPGDHSD17B10ALDH1A1 | |
| SCHEMBL233765 | 0.79 | MAPT (0.63) | KDM4EMAPTHPGDHSD17B10ALDH1A1 | |
| SCHEMBL23086057 | 0.75 | ALOX15 (0.46) | HDAC1KDM4EMAPTHPGDHSD17B10 | |
| SCHEMBL7517472 | 0.74 | MEN1 (0.58) | KDM4EMAPTHPGDHSD17B10ALDH1A1 | |
| SCHEMBL2404127 | 0.74 | TDP1 (0.50) | KDM4ELMNATDP1GAAMEN1 | |
| SCHEMBL27575347 | 0.72 | TDP1 (0.46) | KDM4EMAPTTDP1GAAMEN1 | |
| SCHEMBL8620843 | 0.72 | ALOX15 (0.50) | KDM4EMAPTHPGDHSD17B10ALDH1A1 | |
| SCHEMBL8790742 | 0.72 | ALOX15 (0.50) | KDM4EMAPTHPGDHSD17B10ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5750701-A | Heterocyclic ethanolamine derivatives with β-adrenoreceptor agonistic activity | SMITHKLINE BEECHAM PLC (GB) | 1998-05-12 | — | — | US | disclosed |
| EP-0750617-A1 | NOVEL HETEROCYCLIC ETHANOLAMINE DERIVATIVES WITH BETA-ADRENORECEPTOR AGONISTIC ACTIVITY | SMITHKLINE BEECHAM PLC (GB) | 1997-01-02 | — | — | EP | disclosed |
| WO-1995025104-A1 | NOVEL HETEROCYCLIC ETHANOLAMINE DERIVATIVES WITH BETA-ADRENORECEPTOR AGONISTIC ACTIVITY | SMITHKLINE BEECHAM P.L.C. (GB) | 1995-09-21 | — | — | WO | disclosed |