Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.46 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | PTPRC | P08575 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14349890 | 0.86 | ABCB11 (0.58) | ABCB11 | |
| SCHEMBL13064827 | 0.81 | CA12 (0.50) | ALDH1A1 | |
| SCHEMBL10985847 | 0.80 | HDAC1 (0.67) | ALDH1A1PPARGPPARAHDAC1HDAC8 | |
| SCHEMBL17451237 | 0.79 | UGT2B7 (0.50) | ALDH1A1ABCB11MMP9 | |
| SCHEMBL27913110 | 0.77 | TSHR (0.44) | ALDH1A1 | |
| SCHEMBL6888083 | 0.76 | UGT2B7 (0.46) | ABCB11 | |
| SCHEMBL2488020 | 0.76 | UGT2B7 (0.48) | PPARGPPARAABCB11 | |
| SCHEMBL30421518 | 0.76 | UGT2B7 (0.48) | PPARGPPARAABCB11 | |
| SCHEMBL7149177 | 0.76 | MAPT (0.47) | ALDH1A1 | |
| SCHEMBL13070018 | 0.75 | HDAC1 (0.76) | HDAC1HDAC8 |
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-0174271-B1 | ANTHRACEME DERIVATIVES | CIBA-GEIGY AG (CH) | 1991-10-16 | — | — | EP | disclosed |
| EP-0174271-A2 | Anthraceme derivatives | CIBA-GEIGY AG (CH) | 1986-03-12 | — | — | EP | disclosed |