Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8852239 | 0.90 | LMNA (0.42) | LMNA | |
| SCHEMBL8851103 | 0.79 | ALDH1A1 (0.39) | ALDH1A1HPGDSIGMAR1LMNA | |
| SCHEMBL8852336 | 0.78 | CACNA2D1 (0.32) | — | |
| SCHEMBL8851005 | 0.75 | CHRNB2 (0.37) | ALDH1A1 | |
| SCHEMBL8850964 | 0.75 | ALDH1A1 (0.41) | ALDH1A1HPGDSIGMAR1 | |
| SCHEMBL8852127 | 0.75 | DRD2 (0.32) | — | |
| SCHEMBL8852102 | 0.74 | CACNA2D1 (0.41) | SIGMAR1LMNA | |
| SCHEMBL8851196 | 0.73 | — | — | |
| SCHEMBL8851254 | 0.72 | LMNA (0.32) | LMNA | |
| SCHEMBL8851143 | 0.72 | ALDH1A1 (0.36) | ALDH1A1HPGDSIGMAR1 |
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 |