Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.64 |
| ▸ | STAT3 | P40763 | 1/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.64 |
| ▸ | GLA | P06280 | 2/20 | 0.58 |
| ▸ | PTGDR2 | Q9Y5Y4 | 4/20 | 0.51 |
| ▸ | APEX1 | P27695 | 1/20 | 0.50 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | CASP1 | P29466 | 1/20 | 0.49 |
| ▸ | CASP7 | P55210 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL11601199 | 0.83 | ALDH1A1 (0.71) | ALDH1A1MAPK1STAT3KDM4EGLA | |
| SCHEMBL1757397 | 0.83 | KDM4E (0.56) | ALDH1A1MAPK1STAT3KDM4EPOLB | |
| SCHEMBL1757824 | 0.80 | ALDH1A1 (0.50) | ALDH1A1MAPK1STAT3KDM4EL3MBTL1 | |
| SCHEMBL29951813 | 0.79 | ALDH1A1 (0.62) | ALDH1A1MAPK1STAT3KDM4EGLA | |
| SCHEMBL12219585 | 0.79 | ALDH1A1 (0.62) | ALDH1A1MAPK1STAT3KDM4EGLA | |
| SCHEMBL4559216 | 0.79 | ALDH1A1 (0.62) | ALDH1A1MAPK1STAT3KDM4EGLA | |
| SCHEMBL1759180 | 0.79 | PTGDR2 (0.60) | PTGDR2AKR1B1 | |
| SCHEMBL150053 | 0.79 | KDM4E (1.00) | ALDH1A1MAPK1STAT3KDM4EGLA | |
| SCHEMBL29859932 | 0.79 | KDM4E (1.00) | ALDH1A1MAPK1STAT3KDM4EGLA | |
| SCHEMBL23865499 | 0.78 | SMN1; SMN2 (0.70) | ALDH1A1MAPK1STAT3KDM4EGLA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013010881-A1 | NEW CRTh2 ANTAGONISTS | ALMIRALL, S.A. (ES) | 2013-01-24 | — | — | WO | disclosed |
| EP-2548863-A1 | New CRTh2 antagonists. | Almirall, S.A. (ES) | 2013-01-23 | — | — | EP | disclosed |
| WO-2011055270-A1 | INDOLE BASED RECEPTOR CRTH2 ANTAGONISTS | WYETH LLC (US) | 2011-05-12 | — | — | WO | disclosed |