Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | HCAR1 | Q9BXC0 | 7/20 | 0.49 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RXRA | P19793 | 3/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.32 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.32 |
| ▸ | GABRP | O00591 | 1/20 | 0.32 |
| ▸ | GABRD | O14764 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 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 | |
|---|---|---|---|---|
| SCHEMBL9894753 | 0.83 | HCAR1 (0.49) | PKMHCAR1IDO1KAT2BCYP1A2 | |
| SCHEMBL1437796 | 0.76 | MDM2 (0.47) | HCAR1GRIN1GRIN2B | |
| SCHEMBL3612886 | 0.69 | PKM (0.55) | PKMHCAR1KDM4EALDH1A1 | |
| SCHEMBL986323 | 0.63 | HCAR1 (0.40) | HCAR1IDO1KAT2BALDH1A1RXRA | |
| SCHEMBL2191670 | 0.63 | HCAR1 (0.54) | HCAR1IDO1KAT2BRXRAGRIN1 | |
| SCHEMBL14692466 | 0.63 | NOTUM (0.53) | HCAR1IDO1KAT2BCYP1A2CYP2D6 | |
| SCHEMBL15933292 | 0.63 | HCAR1 (0.48) | HCAR1IDO1KAT2BCYP1A2CYP2D6 | |
| SCHEMBL4055988 | 0.63 | ADORA2A (0.41) | PKMKDM4EALDH1A1POLB | |
| SCHEMBL986522 | 0.62 | P2RX7 (0.39) | HCAR1IDO1KAT2BALDH1A1RXRA | |
| SCHEMBL9050137 | 0.62 | GABRG2 (0.47) | CYP3A4CYP2C9GABRPGABRDGABRA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2470502-A1 | TETRA-SUBSTITUTED HETEROARYL COMPOUNDS AND THEIR USE AS MDM2 AND/OR MDM4 MODULATORS | Novartis AG (CH) | 2012-07-04 | — | — | EP | disclosed |
| WO-2011023677-A1 | TETRA-SUBSTITUTED HETEROARYL COMPOUNDS AND THEIR USE AS MDM2 AND/OR MDM4 MODULATORS | NOVARTIS AG (CH) | 2011-03-03 | — | — | WO | disclosed |