Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC1A3 | P43003 | 1/20 | 0.50 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.50 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | ITGAV | P06756 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | EDNRA | P25101 | 2/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.39 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.39 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.39 |
| ▸ | EDNRB | P24530 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8851832 | 0.87 | SLC1A3 (0.54) | SLC1A3SLC1A2SLC1A1ALDH1A1LMNA | |
| SCHEMBL20478178 | 0.86 | SLC1A3 (0.53) | SLC1A3SLC1A2SLC1A1ALDH1A1LMNA | |
| SCHEMBL9001208 | 0.82 | SLC1A3 (0.55) | SLC1A3SLC1A2SLC1A1ALDH1A1LMNA | |
| SCHEMBL8851519 | 0.78 | SLC1A3 (0.49) | SLC1A3SLC1A2SLC1A1ALDH1A1LMNA | |
| SCHEMBL8851493 | 0.78 | SLC1A3 (0.49) | SLC1A3SLC1A2SLC1A1ALDH1A1LMNA | |
| SCHEMBL23518183 | 0.75 | SLC1A3 (0.49) | SLC1A3SLC1A2SLC1A1ALDH1A1LMNA | |
| SCHEMBL27895996 | 0.75 | SLC1A3 (0.64) | SLC1A3SLC1A2SLC1A1ALDH1A1LMNA | |
| SCHEMBL14798294 | 0.75 | SLC1A3 (0.64) | SLC1A3SLC1A2SLC1A1ALDH1A1LMNA | |
| SCHEMBL10765699 | 0.75 | SLC1A3 (0.64) | SLC1A3SLC1A2SLC1A1ALDH1A1LMNA | |
| SCHEMBL10530500 | 0.74 | ALDH1A1 (0.49) | SLC1A3SLC1A2SLC1A1ALDH1A1LMNA |
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 |