Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | WDR5 | P61964 | 4/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NISCH | Q9Y2I1 | 8/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Iodide SCHEMBL949559 | 0.99 | WDR5 (0.46) | SLC6A2SLC6A4WDR5NPSR1L3MBTL1 | |
| SCHEMBL4114349 | 0.93 | WDR5 (0.48) | SLC6A2SLC6A4WDR5NPSR1L3MBTL1 | |
| SCHEMBL949042 | 0.87 | KDM4E (0.52) | NPSR1L3MBTL1KDM4EHTTNISCH | |
| SCHEMBL4788615 | 0.86 | PTGIR (0.44) | SLC6A2SLC6A4NPSR1L3MBTL1KDM4E | |
| SCHEMBL4785397 | 0.86 | PTGIR (0.47) | WDR5NPSR1L3MBTL1KDM4EHTT | |
| SCHEMBL4106896 | 0.86 | WDR5 (0.48) | SLC6A2SLC6A4WDR5NPSR1NISCH | |
| Iodide SCHEMBL951481 | 0.86 | KDM4E (0.51) | NPSR1L3MBTL1KDM4EHTTNISCH | |
| SCHEMBL4786568 | 0.86 | HTR1B (0.49) | SLC6A2SLC6A4WDR5NPSR1L3MBTL1 | |
| SCHEMBL4788583 | 0.86 | NISCH (0.43) | NPSR1L3MBTL1KDM4EHTTNISCH | |
| SCHEMBL3431450 | 0.83 | WDR5 (0.46) | WDR5NPSR1KDM4ENISCHCYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101184737-B | 1-(imidazolin-2-yl)amino-1,2-diphenylethane compounds for combating animal pests | BASF SE | 2012-12-26 | — | — | CN | disclosed |
| WO-2008123821-A1 | 4, 5-DIHYDRO-LH-IMIDAZOL-2-AMINE DERIVATIVES FOR USE IN THE TREATMENT OF RESPIRATORY, CARDIOVASCULAR, NEUROLOGICAL OR GASTROINTESTINAL DISORDERS | ALBIREO AB (SE) | 2008-10-16 | — | — | WO | disclosed |
| CN-101184737-A | 1-(imidazolin-2-yl)amino-1,2-diphenylethane compounds for combating animal pests | BASF SE (DE) | 2008-05-21 | — | — | CN | disclosed |