Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.31 |
| ▸ | MAT2A | P31153 | 1/20 | 0.31 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CHKA | P35790 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30032746 | 0.81 | ALDH1A1 (0.36) | HSP90AA1HSP90AB1KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL2159069 | 0.81 | ALDH1A1 (0.36) | HSP90AA1HSP90AB1KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL14630424 | 0.75 | HSP90AA1 (0.36) | HSP90AA1HSP90AB1KDM4EALDH1A1PTGS2 | |
| SCHEMBL898882 | 0.73 | HSP90AA1 (0.38) | HSP90AA1HSP90AB1KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL29745069 | 0.73 | HSP90AA1 (0.38) | HSP90AA1HSP90AB1KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL25371113 | 0.71 | HSP90AA1 (0.36) | HSP90AA1HSP90AB1KDM4EHSD17B10ALDH1A1 | |
| Hydrochloric Acid SCHEMBL14127591 | 0.71 | HSP90AA1 (0.36) | HSP90AA1HSP90AB1KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL830696 | 0.71 | HSP90AA1 (0.36) | HSP90AA1HSP90AB1KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL30303053 | 0.71 | HSP90AA1 (0.36) | HSP90AA1HSP90AB1KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL24169965 | 0.70 | PDPK1 (0.33) | — |
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-2013010880-A1 | NEW CRTH2 ANTAGONISTS | ALMIRALL, S.A. (ES) | 2013-01-24 | — | — | WO | disclosed |
| EP-2548876-A1 | New CRTh2 antagonists | Almirall, S.A. (ES) | 2013-01-23 | — | — | EP | disclosed |