Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.45 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.45 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | CDC25B | P30305 | 2/20 | 0.43 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 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 | |
|---|---|---|---|---|
| SCHEMBL352597 | 0.89 | CYP3A4 (0.44) | CYP3A4ALDH1A1TSHRHSD17B10NR4A1 | |
| SCHEMBL2777499 | 0.88 | NR4A1 (0.45) | CYP3A4ALDH1A1TSHRHSD17B10NR4A1 | |
| SCHEMBL2115719 | 0.83 | CYP3A4 (0.72) | CYP3A4ALDH1A1TSHRHSD17B10NR4A1 | |
| SCHEMBL4910288 | 0.82 | CDC25B (0.60) | CYP3A4ALDH1A1TSHRHSD17B10NR4A1 | |
| SCHEMBL8516839 | 0.81 | CYP3A4 (0.50) | CYP3A4ALDH1A1TSHRHSD17B10NR4A1 | |
| SCHEMBL2777501 | 0.81 | CNR2 (0.47) | CYP3A4ALDH1A1TSHRHSD17B10NR4A1 | |
| SCHEMBL76920 | 0.80 | NR4A1 (0.49) | CYP3A4ALDH1A1TSHRHSD17B10NR4A1 | |
| SCHEMBL7561802 | 0.79 | CYP3A4 (0.45) | CYP3A4ALDH1A1TSHRHSD17B10L3MBTL1 | |
| SCHEMBL27648071 | 0.79 | NR4A1 (0.45) | CYP3A4ALDH1A1TSHRHSD17B10NR4A1 | |
| SCHEMBL10641793 | 0.78 | CYP3A4 (0.51) | CYP3A4ALDH1A1TSHRHSD17B10NR4A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992000547-A1 | POLYMERIC COMPOSITIONS | BRITISH TELECOMMUNICATIONS PUBLIC LIMITED COMPANY (GB) | 1992-01-09 | — | — | WO | disclosed |