Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 4/20 | 0.36 |
| ▸ | PGR | P06401 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 3/20 | 0.32 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.32 |
| ▸ | CDK1 | P06493 | 1/20 | 0.32 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | CCNB3 | Q8WWL7 | 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 | |
|---|---|---|---|---|
| SCHEMBL9733278 | 0.99 | PGR (0.36) | HTR1APGRALDH1A1HPGDHTR2A | |
| SCHEMBL9733284 | 0.84 | HTR1A (0.37) | HTR1APGRALDH1A1BACE1CCNB2 | |
| SCHEMBL9733267 | 0.82 | HTR1A (0.38) | HTR1APGRALDH1A1BACE1CCNB2 | |
| SCHEMBL9733783 | 0.81 | HTR1A (0.36) | HTR1APGRALDH1A1BACE1 | |
| SCHEMBL8084380 | 0.77 | OPRD1 (0.39) | HTR1APGRHTR2ABACE1 | |
| SCHEMBL8090132 | 0.76 | OPRD1 (0.39) | HTR1APGRHTR2ABACE1 | |
| SCHEMBL8084291 | 0.76 | OPRD1 (0.39) | HTR1APGRHTR2ABACE1 | |
| SCHEMBL9732955 | 0.75 | CYP19A1 (0.44) | HTR1AHTR2AHTR2C | |
| SCHEMBL9733561 | 0.75 | PGR (0.36) | HTR1APGRALDH1A1BACE1 | |
| SCHEMBL8175110 | 0.75 | OPRD1 (0.39) | HTR1AHTR2ABACE1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5132307-A | TETRALIN COMPOUNDS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1992-07-21 | — | — | US | disclosed |
| EP-0368160-A1 | Tetralin derivatives | MERCK PATENT GmbH (DE) | 1990-05-16 | — | — | EP | disclosed |