Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | GPR84 | Q9NQS5 | 5/20 | 0.36 |
| ▸ | PI4KA | P42356 | 1/20 | 0.35 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.35 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.35 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | DHFR | P00374 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | GSR | P00390 | 1/20 | 0.32 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10816236 | 0.81 | KCNH2 (0.36) | KCNH2GPR84ALDH1A1MEN1GAA | |
| SCHEMBL9762264 | 0.78 | KCNH2 (0.37) | KCNH2GPR84ALDH1A1PKMHPGD | |
| SCHEMBL9761786 | 0.71 | ALDH1A1 (0.38) | KCNH2GPR84ALDH1A1HPGD | |
| SCHEMBL10399826 | 0.68 | GPR84 (0.46) | GPR84KMT2A | |
| SCHEMBL11325593 | 0.65 | ALDH1A1 (0.41) | KCNH2ALDH1A1DHFRL3MBTL1MEN1 | |
| SCHEMBL28052800 | 0.64 | ALDH1A1 (0.39) | KCNH2GPR84ALDH1A1PKMHPGD | |
| SCHEMBL28138958 | 0.64 | ALDH1A1 (0.39) | KCNH2GPR84ALDH1A1PKMHPGD | |
| SCHEMBL28139630 | 0.64 | ALDH1A1 (0.39) | KCNH2GPR84ALDH1A1PKMHPGD | |
| SCHEMBL1123622 | 0.64 | KMT2A (0.46) | GPR84ALDH1A1DHFRMEN1GAA | |
| SCHEMBL6121227 | 0.64 | KMT2A (0.46) | GPR84ALDH1A1DHFRMEN1GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-5026694-A | Antitumor agents | THE BRITISH COLUMBIA CANCER FOUNDATION (CA) | 1991-06-25 | — | — | US | disclosed |