Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 4/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.39 |
| ▸ | LIG1 | P18858 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.35 |
| ▸ | HTR1A | P08908 | 3/20 | 0.35 |
| ▸ | HTR2A | P28223 | 3/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL25364723 | 0.83 | LMNA (0.40) | ALDH1A1HPGDMAPK1TSHRGAA | |
| SCHEMBL12375200 | 0.77 | MEN1 (0.42) | ALDH1A1HPGDMAPK1TSHRGAA | |
| SCHEMBL15466707 | 0.76 | HPGD (0.46) | ALDH1A1HPGDMAPK1TSHRGAA | |
| SCHEMBL9709192 | 0.75 | HSD17B10 (0.50) | ALDH1A1HPGDTSHRGAALMNA | |
| SCHEMBL5003240 | 0.75 | MAPK1 (0.43) | ALDH1A1HPGDMAPK1TSHRGAA | |
| SCHEMBL7589231 | 0.75 | MEN1 (0.42) | ALDH1A1LMNACYP2D6MEN1KMT2A | |
| SCHEMBL5485443 | 0.75 | MEN1 (0.42) | ALDH1A1LMNACYP2D6MEN1KMT2A | |
| SCHEMBL358283 | 0.75 | LMNA (0.45) | ALDH1A1HPGDTSHRLMNAHTT | |
| SCHEMBL1937996 | 0.74 | KDM4E (0.42) | ALDH1A1HPGDMAPK1TSHRGAA | |
| SCHEMBL2525832 | 0.74 | TSHR (0.44) | ALDH1A1HPGDMAPK1TSHRGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-6797819-B1 | Alkaloids | PRESIDENT AND FELLOWS OF HARVARD COLLEGE | 2004-09-28 | — | — | US | disclosed |