Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.45 |
| ▸ | AURKA | O14965 | 2/20 | 0.42 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6876167 | 1.00 | NPC1 (0.47) | NPC1RAB9AEPHX2EPHX1AURKA | |
| SCHEMBL6876601 | 0.98 | EPHX2 (0.46) | NPC1RAB9AEPHX2EPHX1AURKA | |
| SCHEMBL6876610 | 0.98 | EPHX2 (0.46) | NPC1RAB9AEPHX2EPHX1AURKA | |
| SCHEMBL6866756 | 0.93 | NPC1 (0.56) | NPC1RAB9AEPHX2EPHX1MAPT | |
| SCHEMBL6866751 | 0.93 | NPC1 (0.56) | NPC1RAB9AEPHX2EPHX1MAPT | |
| SCHEMBL6877142 | 0.90 | RAB9A (0.47) | NPC1RAB9AEPHX2EPHX1MAPT | |
| SCHEMBL6877139 | 0.90 | RAB9A (0.47) | NPC1RAB9AEPHX2EPHX1MAPT | |
| SCHEMBL6879538 | 0.90 | EPHX1 (0.56) | NPC1RAB9AEPHX2EPHX1AURKB | |
| SCHEMBL6879546 | 0.90 | EPHX1 (0.56) | NPC1RAB9AEPHX2EPHX1AURKB | |
| SCHEMBL6874878 | 0.88 | NPC1 (0.54) | NPC1RAB9AEPHX2EPHX1AURKB |
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 |