Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 11/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 10/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.36 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.34 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.34 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8851330 | 0.89 | LMNA (0.46) | SLC6A4KCNH2SLC6A2SLC6A3GNAI3 | |
| SCHEMBL8851241 | 0.84 | SIGMAR1 (0.42) | SIGMAR1ALDH1A1HPGDSLC6A4KCNH2 | |
| SCHEMBL8851304 | 0.83 | ALDH1A1 (0.35) | ALDH1A1SLC6A4KCNH2SLC6A2SLC6A3 | |
| SCHEMBL8851559 | 0.81 | ALDH1A1 (0.42) | SIGMAR1ALDH1A1HPGDLMNA | |
| SCHEMBL8852087 | 0.81 | LMNA (0.48) | SIGMAR1SLC6A4SLC6A2GNAI3GNAO1 | |
| SCHEMBL1829058 | 0.79 | SLC6A4 (0.40) | SLC6A4KCNH2SLC6A2SLC6A3GNAI3 | |
| SCHEMBL8851123 | 0.79 | SIGMAR1 (0.43) | SIGMAR1ALDH1A1HPGDSLC6A4KCNH2 | |
| SCHEMBL22878517 | 0.78 | SMYD3 (0.38) | ALDH1A1SLC6A4KCNH2SLC6A2SLC6A3 | |
| Hydrochloric Acid SCHEMBL17271572 | 0.77 | SMYD3 (0.37) | ALDH1A1SLC6A4KCNH2SLC6A2SLC6A3 | |
| SCHEMBL8851878 | 0.77 | SLC6A4 (0.40) | SIGMAR1ALDH1A1HPGDSLC6A4KCNH2 |
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-5618814-A | Trisubstituted pyrimido [5,4-d] pyrimidines for modulating multi-drug resistance and pharmaceutical compositions containing these compounds | DR. KARL THOMAE GMBH (DE) | 1997-04-08 | — | — | US | disclosed |