Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.33 |
| ▸ | HTR1A | P08908 | 2/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.33 |
| ▸ | DRD1 | P21728 | 2/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11534015 | 0.92 | CYP19A1 (0.42) | TSHRCYP19A1HSP90AA1ALDH1A1MAOA | |
| SCHEMBL11538629 | 0.92 | TSHR (0.41) | TSHRCYP19A1POLBHSP90AA1CYP3A4 | |
| SCHEMBL11536263 | 0.88 | TSHR (0.39) | TSHRCYP19A1POLBHSP90AA1CYP3A4 | |
| SCHEMBL11535483 | 0.87 | CYP19A1 (0.45) | TSHRCYP19A1POLBHSP90AA1CYP3A4 | |
| SCHEMBL11531656 | 0.86 | MEN1 (0.44) | TSHRCYP19A1ALDH1A1KMT2AMEN1 | |
| SCHEMBL11532401 | 0.85 | CYP19A1 (0.52) | TSHRCYP19A1ALDH1A1KMT2AMEN1 | |
| SCHEMBL11534916 | 0.84 | KMT2A (0.43) | TSHRCYP19A1HSP90AA1ALDH1A1KMT2A | |
| SCHEMBL11536568 | 0.84 | LMNA (0.44) | TSHRCYP19A1HSP90AA1KMT2AMEN1 | |
| SCHEMBL11531483 | 0.81 | KIF11 (0.41) | TSHRCYP19A1POLBHSP90AA1ALDH1A1 | |
| SCHEMBL11535926 | 0.80 | KMT2A (0.51) | TSHRCYP19A1POLBHSP90AA1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-4140782-A | Combating fungi and nematodes with diphenyl-triazolyl-methanes | BAYER AKTIENGESELLSCHAFT (DE) | 1979-02-20 | — | — | US | disclosed |