Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 5/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.33 |
| ▸ | GPR55 | Q9Y2T6 | 2/20 | 0.32 |
| ▸ | CDK7 | P50613 | 1/20 | 0.31 |
| ▸ | CDK13 | Q14004 | 1/20 | 0.31 |
| ▸ | ACACB | O00763 | 3/20 | 0.31 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.30 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.30 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8775100 | 0.93 | ESR2 (0.33) | GRIN2BGRIN1PTGS2GPR55CDK7 | |
| SCHEMBL8774704 | 0.92 | PDE5A (0.33) | GRIN2BGRIN1PTGS2GPR55 | |
| SCHEMBL8774654 | 0.91 | GAA (0.33) | GRIN2BGRIN1PTGS2GPR55 | |
| SCHEMBL8774698 | 0.91 | GAA (0.33) | GRIN2BGRIN1PTGS2GPR55 | |
| SCHEMBL8774169 | 0.90 | GRIN2B (0.36) | GRIN2BGRIN1PTGS2GPR55CDK7 | |
| SCHEMBL9158474 | 0.84 | PTGS2 (0.36) | PTGS2ACACB | |
| SCHEMBL8774293 | 0.82 | SLC6A2 (0.36) | PTGS2ACACB | |
| SCHEMBL8774410 | 0.81 | GPR84 (0.36) | GRIN2BGRIN1 | |
| SCHEMBL8774544 | 0.81 | CYP2C9 (0.45) | GRIN2BGRIN1GPR55 | |
| SCHEMBL8774551 | 0.81 | CYP2C9 (0.45) | GRIN2BGRIN1GPR55 |
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-0519370-B1 | Heterocyclic derivatives | MERCK PATENT GMBH (DE) | 1997-11-05 | — | — | EP | disclosed |
| EP-0519370-A2 | Heterocyclic derivatives | MERCK PATENT GmbH (DE) | 1992-12-23 | — | — | EP | disclosed |