Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 2/20 | 0.60 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.60 |
| ▸ | STING1 | Q86WV6 | 14/20 | 0.39 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.37 |
| ▸ | WNT3A | P56704 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.36 |
| ▸ | IRF3 | Q14653 | 1/20 | 0.36 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.35 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2010859 | 0.86 | HCRTR1 (0.66) | HCRTR1HCRTR2CTNNB1WNT3A | |
| SCHEMBL2011853 | 0.81 | HCRTR1 (0.59) | HCRTR1HCRTR2STING1ALDH1A1SMYD3 | |
| SCHEMBL2011420 | 0.81 | HCRTR1 (0.65) | HCRTR1HCRTR2STING1SMYD3IRF3 | |
| SCHEMBL2013146 | 0.81 | HCRTR1 (0.66) | HCRTR1HCRTR2SMYD3 | |
| SCHEMBL2051392 | 0.81 | HCRTR1 (0.66) | HCRTR1HCRTR2SMYD3 | |
| SCHEMBL2053609 | 0.80 | HCRTR1 (0.64) | HCRTR1HCRTR2STING1SMYD3IRF3 | |
| SCHEMBL2012845 | 0.80 | HCRTR1 (0.64) | HCRTR1HCRTR2STING1SMYD3IRF3 | |
| SCHEMBL2013624 | 0.80 | HCRTR1 (0.60) | HCRTR1HCRTR2STING1SMYD3IRF3 | |
| SCHEMBL2054242 | 0.80 | HCRTR1 (0.61) | HCRTR1HCRTR2STING1ALDH1A1CYP1A2 | |
| SCHEMBL2014489 | 0.80 | HCRTR1 (0.61) | HCRTR1HCRTR2STING1ALDH1A1CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011073316-A1 | 4-ARYL-BUTANE-1,3-DIAMIDES | NOVARTIS AG (CH) | 2011-06-23 | — | — | WO | claimed |
| WO-2011073316-A1 | 4-ARYL-BUTANE-1,3-DIAMIDES | NOVARTIS AG (CH) | 2011-06-23 | — | — | WO | disclosed |