Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.52 |
| ▸ | ACHE | P22303 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 5/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | ERN1 | O75460 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29513975 | 0.78 | ALDH1A1 (0.50) | ALDH1A1CYP3A4GAANPC1TDP1 | |
| SCHEMBL4406554 | 0.78 | ALDH1A1 (0.50) | ALDH1A1CYP3A4GAANPC1TDP1 | |
| SCHEMBL12653027 | 0.78 | ALDH1A1 (0.47) | ALDH1A1CYP3A4GAANPC1TDP1 | |
| SCHEMBL8761590 | 0.77 | ACHE (0.52) | ALDH1A1CYP3A4ACHEL3MBTL1MAPT | |
| SCHEMBL8056786 | 0.77 | ACHE (0.52) | ALDH1A1CYP3A4ACHEGAAPOLB | |
| SCHEMBL16372539 | 0.77 | ALDH1A1 (0.56) | ALDH1A1CYP3A4ACHEGAANPC1 | |
| SCHEMBL4730926 | 0.77 | ALDH1A1 (0.56) | ALDH1A1CYP3A4ACHEGAANPC1 | |
| SCHEMBL23702702 | 0.77 | POLB (0.47) | ALDH1A1CYP3A4GAANPC1TDP1 | |
| SCHEMBL4407650 | 0.77 | CYP3A4 (0.50) | ALDH1A1CYP3A4GAANPC1TDP1 | |
| SCHEMBL16134103 | 0.75 | POLB (0.46) | ALDH1A1CYP3A4ACHEGAAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010012396-A1 | 5,6 SUBSTITUTED BENZAMIDE DERIVATIVES AS MODULATORS OF THE EP<SB>2 </SB>RECEPTOR | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2010-02-04 | — | — | WO | disclosed |
| EP-2149552-A1 | 5,6 substituted benzamide derivatives as modulators of EP2 receptors | Bayer Schering Pharma AG (DE) | 2010-02-03 | — | — | EP | disclosed |