Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GNRHR | P30968 | 20/20 | 0.77 |
| ▸ | CYP3A4 | P08684 | 13/20 | 0.73 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.68 |
| ▸ | APLNR | P35414 | 1/20 | 0.68 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.68 |
| ▸ | GLP1R | P43220 | 1/20 | 0.68 |
| ▸ | CX3CR1 | P49238 | 1/20 | 0.68 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.68 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.68 |
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 | |
|---|---|---|---|---|
| SCHEMBL21136105 | 0.92 | GNRHR (0.69) | GNRHRCYP3A4ADRB2APLNROPRK1 | |
| SCHEMBL21135382 | 0.88 | GNRHR (0.84) | GNRHRCYP3A4ADRB2APLNROPRK1 | |
| Elagolix SCHEMBL19549512 | 0.87 | GNRHR (1.00) | GNRHRCYP3A4ADRB2APLNROPRK1 | |
| Elagolix SCHEMBL29365599 | 0.87 | GNRHR (1.00) | GNRHRCYP3A4ADRB2APLNROPRK1 | |
| Elagolix SCHEMBL4677617 | 0.87 | GNRHR (1.00) | GNRHRCYP3A4ADRB2APLNROPRK1 | |
| Elagolix SCHEMBL1642523 | 0.87 | GNRHR (1.00) | GNRHRCYP3A4ADRB2APLNROPRK1 | |
| Elagolix SCHEMBL29396002 | 0.87 | GNRHR (1.00) | GNRHRCYP3A4ADRB2APLNROPRK1 | |
| SCHEMBL24827490 | 0.86 | GNRHR (0.72) | GNRHRCYP3A4ADRB2APLNROPRK1 | |
| Elagolix SCHEMBL1641993 | 0.86 | GNRHR (0.99) | GNRHRCYP3A4ADRB2APLNROPRK1 | |
| Elagolix SCHEMBL1641996 | 0.86 | GNRHR (0.99) | GNRHRCYP3A4ADRB2APLNROPRK1 |
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-2019112968-A1 | PROCESSES TO PRODUCE ELAGOLIX | WANG PENG (US) | 2019-06-13 | — | — | WO | disclosed |