Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.62 |
| ▸ | GPR35 | Q9HC97 | 5/20 | 0.62 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.49 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.49 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 7/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | TTR | P02766 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29350780 | 0.85 | TXNRD1 (0.66) | ALDH1A1GPR35TXNRD1TXNRD3TXNRD2 | |
| SCHEMBL466008 | 0.85 | TXNRD1 (0.66) | ALDH1A1GPR35TXNRD1TXNRD3TXNRD2 | |
| SCHEMBL28121409 | 0.84 | TXNRD1 (0.64) | ALDH1A1GPR35TXNRD1TXNRD3TXNRD2 | |
| Dinitro Cresol SCHEMBL11527181 | 0.79 | GPR35 (0.93) | ALDH1A1GPR35MAPTMEN1KMT2A | |
| Dinitro Cresol SCHEMBL8873755 | 0.79 | GPR35 (1.00) | ALDH1A1GPR35MAPTMEN1KMT2A | |
| Dinitro Cresol SCHEMBL20734 | 0.79 | GPR35 (1.00) | ALDH1A1GPR35MAPTMEN1KMT2A | |
| Dinitro Cresol SCHEMBL29430312 | 0.79 | GPR35 (1.00) | ALDH1A1GPR35MAPTMEN1KMT2A | |
| Dinitro Cresol SCHEMBL1260257 | 0.78 | GPR35 (0.96) | ALDH1A1GPR35MAPTMEN1KMT2A | |
| Dinitro Cresol SCHEMBL7108490 | 0.78 | GPR35 (0.96) | ALDH1A1GPR35MAPTMEN1KMT2A | |
| Dinitro Cresol SCHEMBL6859521 | 0.78 | GPR35 (0.96) | ALDH1A1GPR35MAPTMEN1KMT2A |
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-0010107-B1 | REPELLENT AGAINST AQUATIC ORGANISMS | IHARA CHEMICAL INDUSTRY Co., Ltd. (JP) | 1983-04-13 | — | — | EP | disclosed |