Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.41 |
| ▸ | ITGAV | P06756 | 2/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7473898 | 0.96 | ITGB3 (0.43) | SMN1; SMN2TP53POLBHSD17B10TSHR | |
| SCHEMBL7168998 | 0.93 | SMN1; SMN2 (0.49) | SMN1; SMN2TP53POLBHSD17B10TSHR | |
| SCHEMBL7472561 | 0.93 | ITGB3 (0.41) | SMN1; SMN2TP53POLBHSD17B10TSHR | |
| SCHEMBL7364374 | 0.90 | ITGB3 (0.44) | SMN1; SMN2TP53POLBHSD17B10TSHR | |
| SCHEMBL7368828 | 0.89 | ITGB3 (0.44) | SMN1; SMN2TP53POLBHSD17B10TSHR | |
| SCHEMBL7163531 | 0.88 | ITGB3 (0.44) | SMN1; SMN2TP53POLBHSD17B10TSHR | |
| SCHEMBL7367470 | 0.88 | ITGB3 (0.42) | SMN1; SMN2TP53POLBHSD17B10TSHR | |
| SCHEMBL7372158 | 0.86 | ITGB3 (0.41) | SMN1; SMN2TP53POLBHSD17B10TSHR | |
| SCHEMBL7167847 | 0.85 | ITGB3 (0.42) | SMN1; SMN2TP53POLBHSD17B10TSHR | |
| SCHEMBL7474158 | 0.85 | ITGB3 (0.48) | SMN1; SMN2HSD17B10TSHRITGB3ITGAV |
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 3 patents. 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 |
| EP-0964856-A1 | BICYCLIC AMINO ACIDS | MERCK PATENT GmbH (DE) | 1999-12-22 | — | — | EP | disclosed |
| WO-1998035949-A1 | BICYCLIC AMINO ACIDS | MERCK PATENT GMBH (DE) | 1998-08-20 | — | — | WO | disclosed |