Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | SERPINE1 | P05121 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 5/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6232028 | 1.00 | ALDH1A1 (0.47) | ALDH1A1KMT2AMEN1SERPINE1HPGD | |
| SCHEMBL6232578 | 0.83 | CHRM2 (0.53) | KMT2AMEN1SERPINE1LMNACHRM2 | |
| SCHEMBL6232576 | 0.83 | CHRM2 (0.53) | KMT2AMEN1SERPINE1LMNACHRM2 | |
| SCHEMBL6236142 | 0.80 | CHRM2 (0.57) | KMT2AMEN1CHRM2CHRM4CHRM1 | |
| SCHEMBL6236146 | 0.80 | CHRM2 (0.57) | KMT2AMEN1CHRM2CHRM4CHRM1 | |
| SCHEMBL6235813 | 0.80 | ADRB2 (0.47) | ALDH1A1KMT2AMEN1SERPINE1NPC1 | |
| SCHEMBL6235818 | 0.80 | ADRB2 (0.47) | ALDH1A1KMT2AMEN1SERPINE1NPC1 | |
| SCHEMBL6234235 | 0.79 | POLB (0.55) | ALDH1A1KMT2AMEN1MAPTMAPK1 | |
| SCHEMBL6234232 | 0.79 | POLB (0.55) | ALDH1A1KMT2AMEN1MAPTMAPK1 | |
| SCHEMBL599342 | 0.77 | SMN1; SMN2 (0.56) | ALDH1A1HPGDMAPTHDAC3HDAC1 |
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-2005000855-A1 | PROCESS FOR THE PREPARATION OF ATROPISOMERIC ANALOGUES OF 4-AMINOPYRIDINE | IMPERIAL COLLEGE INNOVATIONS LIMITED (GB) | 2005-01-06 | — | — | WO | disclosed |