Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 5/20 | 0.44 |
| ▸ | ITGAV | P06756 | 5/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | ALPL | P05186 | 1/20 | 0.40 |
| ▸ | ALPI | P09923 | 1/20 | 0.40 |
| ▸ | ALPG | P10696 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL7474158 | 0.95 | ITGB3 (0.48) | ITGB3ITGAVTSHRTHRBALPL | |
| SCHEMBL7167848 | 0.93 | ITGB3 (0.49) | ITGB3ITGAVTSHRTHRBALPL | |
| SCHEMBL7370604 | 0.92 | ITGB3 (0.46) | ITGB3ITGAVTHRBALPLALPI | |
| SCHEMBL7374002 | 0.90 | SMN1; SMN2 (0.45) | ITGB3ITGAVTSHRTHRBHSD17B10 | |
| SCHEMBL7371688 | 0.89 | ITGB3 (0.40) | ITGB3ITGAVTSHRTHRBMEN1 | |
| SCHEMBL7365336 | 0.89 | TSHR (0.43) | TSHRTHRBMEN1KMT2AHSD17B10 | |
| SCHEMBL7161068 | 0.88 | ITGB3 (0.54) | ITGB3ITGAVTSHRTHRBALPL | |
| SCHEMBL7371562 | 0.87 | THRB (0.39) | ITGB3ITGAVTSHRTHRBMEN1 | |
| SCHEMBL7468102 | 0.86 | NPC1 (0.41) | ITGB3ITGAVTSHRTHRBKMT2A | |
| SCHEMBL7370705 | 0.86 | HSD17B10 (0.46) | TSHRTHRBHSD17B10TP53POLB |
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 |