Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | EP300 | Q09472 | 1/20 | 0.36 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.36 |
| ▸ | KAT5 | Q92993 | 1/20 | 0.36 |
| ▸ | KAT8 | Q9H7Z6 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | TYMS | P04818 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11380319 | 0.87 | TDP1 (0.44) | TDP1ALDH1A1ALOX15TYMSNR1H2 | |
| SCHEMBL2363418 | 0.80 | NR1H2 (0.48) | EP300KAT2BKAT5KAT8NR1H2 | |
| SCHEMBL461695 | 0.79 | GABRA1 (0.50) | TDP1HPGDALDH1A1ALOX15LMNA | |
| SCHEMBL8920831 | 0.78 | NR1H2 (0.50) | EP300KAT2BKAT5KAT8NR1H2 | |
| SCHEMBL8340233 | 0.78 | NR1H2 (0.50) | EP300KAT2BKAT5KAT8NR1H2 | |
| SCHEMBL8920874 | 0.78 | NR1H2 (0.50) | EP300KAT2BKAT5KAT8NR1H2 | |
| SCHEMBL8922033 | 0.78 | NR1H2 (0.50) | EP300KAT2BKAT5KAT8NR1H2 | |
| SCHEMBL8920512 | 0.78 | NR1H2 (0.50) | EP300KAT2BKAT5KAT8NR1H2 | |
| SCHEMBL8344455 | 0.78 | NR1H2 (0.50) | EP300KAT2BKAT5KAT8NR1H2 | |
| SCHEMBL8923246 | 0.78 | NR1H2 (0.50) | EP300KAT2BKAT5KAT8NR1H2 |
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-2005105820-A2 | MACROCYCLIC CADMIUM COMPLEXES | UNIVERSITY OF EAST ANGLIA (GB) | 2005-11-10 | — | — | WO | disclosed |