Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 4/20 | 0.42 |
| ▸ | BACE1 | P56817 | 2/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.35 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.35 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | SUV39H2 | Q9H5I1 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6877140 | 1.00 | ACHE (0.42) | ACHEBACE1TRPV1KDM4EALDH1A1 | |
| SCHEMBL6867496 | 0.93 | ACHE (0.44) | ACHEBACE1KDM4EALDH1A1POLB | |
| SCHEMBL6867477 | 0.93 | ACHE (0.44) | ACHEBACE1KDM4EALDH1A1POLB | |
| SCHEMBL6457489 | 0.90 | ACHE (0.40) | ACHEBACE1TRPV1KCNH2CNR1 | |
| SCHEMBL6457478 | 0.90 | ACHE (0.40) | ACHEBACE1TRPV1KCNH2CNR1 | |
| SCHEMBL6876275 | 0.86 | ACHE (0.54) | ACHEBACE1KDM4EALDH1A1POLB | |
| SCHEMBL6876285 | 0.86 | ACHE (0.54) | ACHEBACE1KDM4EALDH1A1POLB | |
| SCHEMBL6875018 | 0.83 | ACHE (0.43) | ACHEBACE1KCNH2MEN1KMT2A | |
| SCHEMBL6875044 | 0.83 | ACHE (0.43) | ACHEBACE1KCNH2MEN1KMT2A | |
| SCHEMBL6875096 | 0.82 | MCHR1 (0.37) | ACHEBACE1KCNH2CNR1AURKB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1464335-A2 | Quinoline, tetrahydroquinoline and pyrimidine derivatives as mch antagonist | Taisho Pharmaceutical Co. Ltd. (JP) | 2004-10-06 | — | — | EP | disclosed |