Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 2/20 | 0.41 |
| ▸ | ITGAV | P06756 | 2/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL7163826 | 0.93 | TP53 (0.41) | ITGB3ITGAVITGA2BMAPTHSD17B10 | |
| SCHEMBL7468102 | 0.90 | NPC1 (0.41) | ITGB3ITGAVHSD17B10TSHRMAPK1 | |
| SCHEMBL7473898 | 0.89 | ITGB3 (0.43) | ITGB3ITGAVITGA2BMAPTHSD17B10 | |
| SCHEMBL7368828 | 0.89 | ITGB3 (0.44) | ITGB3ITGAVITGA2BMAPTHSD17B10 | |
| SCHEMBL7367470 | 0.86 | ITGB3 (0.42) | ITGB3ITGAVITGA2BMAPTHSD17B10 | |
| SCHEMBL7472561 | 0.86 | ITGB3 (0.41) | ITGB3ITGAVITGA2BMAPTHSD17B10 | |
| SCHEMBL7374002 | 0.86 | SMN1; SMN2 (0.45) | ITGB3ITGAVITGA2BMAPTHSD17B10 | |
| SCHEMBL7367335 | 0.85 | GAA (0.40) | HSD17B10TSHRMAPK1ALDH1A1L3MBTL1 | |
| SCHEMBL7371091 | 0.84 | ITGB3 (0.44) | ITGB3ITGAVITGA2BMAPTHSD17B10 | |
| SCHEMBL7472722 | 0.83 | PTPN1 (0.48) | ITGB3ITGAVITGA2BMAPTHSD17B10 |
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 |