Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 2/20 | 0.56 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.56 |
| ▸ | PRSS12 | P56730 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.49 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.49 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.44 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL21701473 | 0.81 | NPC1 (0.51) | MAPTHPGDKDM4ELMNAMEN1 | |
| SCHEMBL21683036 | 0.78 | RXFP1 (0.52) | MAPTHPGDLMNAMALT1MEN1 | |
| SCHEMBL418049 | 0.76 | SERPINE1 (0.63) | MAPTHPGDKDM4ELMNANPSR1 | |
| SCHEMBL21701475 | 0.74 | HDAC1 (0.52) | PRSS12MAPTMALT1SMN1; SMN2ALDH1A1 | |
| SCHEMBL21701477 | 0.74 | KDM1A (0.47) | PRSS12LMNAMALT1SMN1; SMN2NPC1 | |
| SCHEMBL6818580 | 0.73 | ALDH1A1 (0.56) | OPRM1OPRD1MAPTHPGDKDM4E | |
| SCHEMBL419651 | 0.69 | HPGD (0.74) | OPRM1MAPTHPGDKDM4ELMNA | |
| SCHEMBL31337378 | 0.67 | KCNH2 (0.61) | MAPTHPGDKDM4ELMNAMAPKAPK2 | |
| SCHEMBL12547163 | 0.67 | MAPKAPK2 (0.68) | OPRM1OPRD1MAPTMAPKAPK2IRAK4 | |
| SCHEMBL31337423 | 0.67 | KCNH2 (0.53) | OPRM1MAPTHPGDKDM4ELMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020033944-A2 | NON-POLYAMINE BASED POLYAMINE TRANSPORT INHIBITORS AND THEIR USE IN THE TREATMENT OF HUMAN CANCERS | UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) | 2020-02-13 | — | — | WO | disclosed |