Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 4/20 | 0.49 |
| ▸ | THRB | P10828 | 4/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.37 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8551491 | 0.91 | THRA (0.49) | THRATHRBSMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL8548592 | 0.88 | THRA (0.50) | THRATHRBSMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL8551259 | 0.82 | HSD17B10 (0.41) | SMN1; SMN2ALDH1A1POLBL3MBTL1MAPT | |
| SCHEMBL8548540 | 0.82 | THRA (0.44) | THRATHRBSMN1; SMN2ALDH1A1ESR1 | |
| SCHEMBL8549251 | 0.77 | THRA (0.55) | THRATHRBSMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL13664228 | 0.75 | THRA (0.42) | THRATHRBSMN1; SMN2ESR1RAB9A | |
| SCHEMBL17885951 | 0.74 | L3MBTL1 (0.46) | THRATHRBSMN1; SMN2ALDH1A1RAB9A | |
| SCHEMBL13664126 | 0.73 | THRA (0.43) | THRATHRBSMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL17885932 | 0.71 | CYP1A2 (0.50) | SMN1; SMN2ALDH1A1KMT2ARAB9AL3MBTL1 | |
| SCHEMBL8550905 | 0.71 | HSD17B10 (0.45) | ALDH1A1POLBMAPTKDM4EHPGD |
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-0825187-A1 | Condensed pyridazinyl guanidines, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-02-25 | — | — | EP | disclosed |