Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | EP300 | Q09472 | 1/20 | 0.39 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | LPAR3 | Q9UBY5 | 2/20 | 0.33 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.33 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.33 |
| ▸ | F7 | P08709 | 1/20 | 0.33 |
| ▸ | F3 | P13726 | 1/20 | 0.33 |
| ▸ | NAAA | Q02083 | 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 | |
|---|---|---|---|---|
| SCHEMBL7547680 | 1.00 | TSHR (0.40) | TSHREP300GRIK1ALDH1A1BACE1 | |
| SCHEMBL7551481 | 0.93 | EP300 (0.47) | TSHREP300LPAR3F7F3 | |
| SCHEMBL7551483 | 0.93 | EP300 (0.47) | TSHREP300LPAR3F7F3 | |
| SCHEMBL7554693 | 0.85 | — | — | |
| SCHEMBL7554696 | 0.85 | — | — | |
| SCHEMBL73242 | 0.85 | TSHR (0.41) | TSHREP300GRIK1ALDH1A1BACE1 | |
| SCHEMBL11053878 | 0.77 | EP300 (0.48) | TSHREP300BACE1F7F3 | |
| SCHEMBL16287422 | 0.76 | TSHR (0.40) | TSHREP300GRIK1ALDH1A1BACE1 | |
| SCHEMBL16287423 | 0.76 | TSHR (0.40) | TSHREP300GRIK1ALDH1A1BACE1 | |
| SCHEMBL5605179 | 0.75 | EP300 (0.52) | TSHREP300F7F3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0589301-B1 | Carboxynilides derivatives, process for their preparation and fungicidal compositions containing them | BASF AG (DE) | 2002-06-26 | — | — | EP | disclosed |
| US-5438070-A | Agricultural fungicides | BASF AKTIENGESELLSCHAFT (DE) | 1995-08-01 | — | — | US | disclosed |
| EP-0591699-A1 | N-hydroxy-N-phenylcarboxamides, processes for their production and agents containing them for the controlling of harmful fungi | BASF Aktiengesellschaft (DE) | 1994-04-13 | — | — | EP | disclosed |
| EP-0589301-A1 | Carboxynilides derivatives, process for their preparation and fungicidal compositions containing them | BASF Aktiengesellschaft (DE) | 1994-03-30 | — | — | EP | disclosed |
| EP-0589313-A1 | Cyclohex(en)ylcarboxamides, process for their preparation and anti-fungal agents containing them | BASF Aktiengesellschaft (DE) | 1994-03-30 | — | — | EP | disclosed |