Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA7 | P43166 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.46 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.46 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5949785 | 0.84 | ALDH1A1 (0.50) | KMT2AMEN1ALDH1A1GAAMAPT | |
| SCHEMBL3321379 | 0.82 | KDM4E (0.56) | KMT2AMEN1ALDH1A1GAAMAPT | |
| SCHEMBL5445652 | 0.81 | PTGS1 (0.49) | CA12CA1CA2CA7CA9 | |
| SCHEMBL7070888 | 0.81 | HPGDS (0.49) | CA12CA1CA2CA9HSD17B1 | |
| SCHEMBL15775647 | 0.80 | SLC6A3 (0.53) | KMT2AMEN1ALDH1A1HPGDKDM4E | |
| SCHEMBL5949858 | 0.79 | SLC6A4 (0.54) | KMT2AMEN1ALDH1A1GAAMAPT | |
| SCHEMBL17010936 | 0.79 | PTGS1 (0.53) | KMT2AMEN1KDM4ETDP1L3MBTL1 | |
| SCHEMBL16549370 | 0.76 | KDM4E (0.47) | KMT2AMEN1ALDH1A1MAPTKDM4E | |
| SCHEMBL7130108 | 0.76 | KDM4E (0.43) | KMT2AMEN1ALDH1A1GAAMAPT | |
| SCHEMBL7075715 | 0.76 | KDM4E (0.43) | KMT2AMEN1ALDH1A1GAAMAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2003051368-A1 | N-AROYL CYCLIC AMINE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 2003-06-26 | — | — | WO | disclosed |