Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7613158 | 1.00 | CA1 (0.37) | CA1CA2CA9ATMAPEX1 | |
| SCHEMBL9347000 | 0.84 | ATM (0.36) | CA1CA2CA9ATMAPEX1 | |
| SCHEMBL5608973 | 0.84 | CA1 (0.40) | CA1CA2CA9ATMAPEX1 | |
| SCHEMBL26607 | 0.82 | CA1 (0.41) | CA1CA2CA9ATMAPEX1 | |
| SCHEMBL9347011 | 0.82 | CA1 (0.41) | CA1CA2CA9ATMAPEX1 | |
| SCHEMBL29349873 | 0.82 | CA1 (0.41) | CA1CA2CA9ATMAPEX1 | |
| SCHEMBL26106163 | 0.81 | CA1 (0.38) | CA1CA2CA9ATMAPEX1 | |
| Phosphine SCHEMBL7943984 | 0.80 | CA1 (0.40) | CA1CA2CA9ATMAPEX1 | |
| SCHEMBL19514039 | 0.80 | CA1 (0.40) | CA1CA2CA9ATMAPEX1 | |
| SCHEMBL31720630 | 0.80 | CA1 (0.40) | CA1CA2CA9ATMAPEX1 |
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-2002044188-A1 | PALLADACYCLIC COMPOUNDS CONTAINING PHOSPHORUS DONOR LIGANDS, THE LIGANDS AND THE USE OF THE COMPOUNDS IN C-C COUPLING REACTIONS | JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) | 2002-06-06 | — | — | WO | disclosed |
| US-5298644-A | Aryl phosphinites | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-03-29 | — | — | US | disclosed |