Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | S100A4 | P26447 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | PTPRC | P08575 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.40 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.40 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7047827 | 0.86 | GPR35 (0.63) | GPR35TSHRS100A4TDP1ALDH1A1 | |
| SCHEMBL7051298 | 0.80 | TDP1 (0.59) | GPR35TSHRS100A4TDP1ALDH1A1 | |
| SCHEMBL1926046 | 0.79 | TSHR (0.71) | GPR35TSHRS100A4TDP1ALDH1A1 | |
| SCHEMBL118464 | 0.79 | TSHR (0.71) | GPR35TSHRS100A4TDP1ALDH1A1 | |
| SCHEMBL1392515 | 0.77 | TDP1 (0.71) | GPR35TSHRS100A4TDP1ALDH1A1 | |
| Fluoride SCHEMBL29099623 | 0.77 | TSHR (0.68) | GPR35TSHRS100A4TDP1ALDH1A1 | |
| SCHEMBL28529002 | 0.77 | TSHR (0.68) | GPR35TSHRS100A4TDP1ALDH1A1 | |
| SCHEMBL7157905 | 0.77 | TSHR (0.68) | GPR35TSHRS100A4TDP1ALDH1A1 | |
| SCHEMBL7157907 | 0.77 | TSHR (0.68) | GPR35TSHRS100A4TDP1ALDH1A1 | |
| SCHEMBL29669769 | 0.77 | TSHR (0.68) | GPR35TSHRS100A4TDP1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1082297-A1 | SUBSTITUTED DITHIO-BIS-NITROBENZENES AND THEIR APPLICATIONS | INSTITUT PASTEUR DE LILLE (FR) | 2001-03-14 | — | — | EP | disclosed |
| WO-1999061416-A1 | SUBSTITUTED DITHIO-BIS-NITROBENZENES AND THEIR APPLICATIONS | INSTITUT PASTEUR DE LILLE (FR) | 1999-12-02 | — | — | WO | disclosed |