Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 5/20 | 0.39 |
| ▸ | ITGAV | P06756 | 5/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL7164502 | 0.94 | ITGB3 (0.44) | ALDH1A1TSHRITGB3ITGAVMAPT | |
| SCHEMBL4685325 | 0.86 | TSHR (0.38) | TSHRITGB3ITGAVMAPTTP53 | |
| SCHEMBL7368163 | 0.86 | BACE1 (0.39) | TSHRITGB3ITGAVMAPTHSD17B10 | |
| SCHEMBL7479025 | 0.85 | ITGB3 (0.39) | TSHRITGB3ITGAVMAPTTP53 | |
| SCHEMBL7365478 | 0.85 | ITGB3 (0.38) | TSHRITGB3ITGAVMAPTTP53 | |
| SCHEMBL14181804 | 0.84 | TSHR (0.37) | TSHRMAPTTP53POLBSMN1; SMN2 | |
| SCHEMBL4685454 | 0.83 | ITGB3 (0.36) | TSHRITGB3ITGAVMAPTHSD17B10 | |
| SCHEMBL4682220 | 0.83 | THRB (0.36) | TSHRITGB3ITGAVMAPTTP53 | |
| SCHEMBL4850590 | 0.81 | CCKAR (0.35) | TSHRITGB3ITGAVMAPTTP53 | |
| SCHEMBL4682248 | 0.80 | ITGB3 (0.36) | TSHRITGB3ITGAVMAPTTP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0964856-B1 | BICYCLIC AMINO ACIDS | MERCK PATENT GMBH (DE) | 2002-10-09 | — | — | EP | disclosed |