Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALKBH3 | Q96Q83 | 2/20 | 0.36 |
| ▸ | AHR | P35869 | 2/20 | 0.34 |
| ▸ | MAOB | P27338 | 3/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.32 |
| ▸ | MAPK10 | P53779 | 3/20 | 0.32 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 2/20 | 0.32 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.32 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.32 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.32 |
| ▸ | PDGFRA | P16234 | 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 | |
|---|---|---|---|---|
| SCHEMBL5887320 | 0.85 | ACHE (0.33) | ALKBH3CYP2D6CYP2C9HPGDALOX15 | |
| SCHEMBL5887180 | 0.85 | ALKBH3 (0.33) | ALKBH3AHRMAOBSLC6A2SLC6A3 | |
| SCHEMBL5887032 | 0.85 | PTGS2 (0.35) | ALKBH3CYP2D6CYP2C9HPGDALOX15 | |
| SCHEMBL5887143 | 0.85 | PTGS2 (0.35) | ALKBH3CYP2D6CYP2C9HPGDALOX15 | |
| SCHEMBL5887105 | 0.84 | ESR2 (0.35) | SLC6A3MAPK10 | |
| SCHEMBL5887353 | 0.82 | MEN1 (0.35) | ALKBH3HSD17B10 | |
| SCHEMBL6047646 | 0.81 | CYP2D6 (0.32) | ALKBH3CYP2D6CYP2C9HPGDALOX15 | |
| SCHEMBL6994658 | 0.80 | AHR (0.38) | AHRSLC6A2SLC6A3MAPK10MAPK8 | |
| SCHEMBL5887287 | 0.80 | ACHE (0.46) | ALKBH3HPGDEGFR | |
| SCHEMBL5887426 | 0.80 | MEN1 (0.34) | ALKBH3CYP2D6CYP2C9HPGDALOX15 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2006501194-A | — | — | 2006-01-12 | — | — | JP | claimed |
| EP-1525190-A1 | CCK-1 RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2005-04-27 | — | — | EP | claimed |
| WO-2004007463-A1 | CCK-1 RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA, N.V. (BE) | 2004-01-22 | — | — | WO | claimed |