Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX1 | Q96LB2 | 4/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.38 |
| ▸ | DHODH | Q02127 | 6/20 | 0.37 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | GPR6 | P46095 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19458056 | 0.89 | TSHR (0.42) | MRGPRX1DHODHMAPTGPR6MEN1 | |
| SCHEMBL29419142 | 0.89 | RECQL (0.41) | MRGPRX1DHODHMAPTGPR6MEN1 | |
| SCHEMBL232894 | 0.89 | RECQL (0.41) | MRGPRX1DHODHMAPTGPR6MEN1 | |
| SCHEMBL374012 | 0.86 | RECQL (0.43) | DHODHMAPTMEN1KMT2AUSP2 | |
| SCHEMBL303117 | 0.84 | CHRM3 (0.47) | CHRM3DHODHNTRK1MAPTMEN1 | |
| SCHEMBL29445380 | 0.84 | CHRM3 (0.47) | CHRM3DHODHNTRK1MAPTMEN1 | |
| SCHEMBL374329 | 0.80 | TP53 (0.45) | CHRM3NTRK1MAPTMEN1KMT2A | |
| SCHEMBL302442 | 0.80 | CHRM3 (0.48) | CHRM3NTRK1MAPTMEN1KMT2A | |
| SCHEMBL17510947 | 0.80 | MEN1 (0.38) | MRGPRX1DHODHMAPTGPR6MEN1 | |
| SCHEMBL16618018 | 0.80 | CHRM3 (0.43) | CHRM3DHODHNTRK1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2218717-A1 | Fungicidal N-((HET)Arylethyl)thiocarboxamide derivatives | Bayer CropScience AG (DE) | 2010-08-18 | — | — | EP | disclosed |