Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 2/20 | 0.35 |
| ▸ | CNR2 | P34972 | 2/20 | 0.34 |
| ▸ | PGR | P06401 | 3/20 | 0.33 |
| ▸ | HTR1A | P08908 | 4/20 | 0.33 |
| ▸ | F10 | P00742 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.32 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.31 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.31 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9374251 | 0.99 | BACE1 (0.36) | BACE1CNR2PGRHTR1AF10 | |
| SCHEMBL9373199 | 0.83 | ABCC9 (0.36) | BACE1HTR1AF10MALT1PDE4A | |
| SCHEMBL9373191 | 0.80 | BACE1 (0.34) | BACE1PGRHTR1AF10HTR2A | |
| SCHEMBL9374693 | 0.79 | ABCC9 (0.33) | BACE1PGRHTR1AF10MALT1 | |
| SCHEMBL8084291 | 0.78 | OPRD1 (0.39) | BACE1CNR2PGRHTR1AF10 | |
| SCHEMBL8090132 | 0.78 | OPRD1 (0.39) | BACE1CNR2PGRHTR1AF10 | |
| SCHEMBL8084380 | 0.77 | OPRD1 (0.39) | BACE1CNR2PGRHTR1AF10 | |
| SCHEMBL8088358 | 0.76 | MALT1 (0.35) | BACE1CNR2PGRHTR1AHTR2A | |
| SCHEMBL8090669 | 0.75 | MALT1 (0.36) | BACE1PGRHTR1AHTR2ANPY5R | |
| SCHEMBL8175110 | 0.74 | OPRD1 (0.39) | BACE1CNR2HTR1AF10HTR2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0371312-B1 | Benzoxazine derivatives | MERCK PATENT GMBH (DE) | 1994-07-20 | — | — | EP | disclosed |
| US-5036068-A | Cardiovascular disorders | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-07-30 | — | — | US | disclosed |
| EP-0371312-A1 | Benzoxazine derivatives | MERCK PATENT GmbH (DE) | 1990-06-06 | — | — | EP | disclosed |