Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 2/20 | 0.44 |
| ▸ | ITGAV | P06756 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 2/20 | 0.39 |
| ▸ | MMP9 | P14780 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7164177 | 0.95 | ITGB3 (0.47) | ITGB3ITGAVALDH1A1TSHRL3MBTL1 | |
| SCHEMBL7374585 | 0.88 | MMP2 (0.44) | ITGB3ALDH1A1L3MBTL1MMP2MMP9 | |
| SCHEMBL7365624 | 0.86 | CASP1 (0.41) | TSHRL3MBTL1MMP2MMP9HSD17B10 | |
| SCHEMBL7475931 | 0.85 | ALOX15 (0.42) | TSHRL3MBTL1MMP2MMP9HSD17B10 | |
| SCHEMBL7364535 | 0.85 | ALOX15 (0.41) | ITGB3ITGAVTSHRL3MBTL1MMP2 | |
| SCHEMBL7479990 | 0.84 | HSD17B10 (0.40) | ITGB3ITGAVALDH1A1L3MBTL1HSD17B10 | |
| SCHEMBL7364118 | 0.83 | ALOX15 (0.43) | ITGB3ITGAVL3MBTL1HSD17B10ALOX15 | |
| SCHEMBL7476728 | 0.83 | ALDH1A1 (0.49) | ITGB3ITGAVALDH1A1TSHRMEN1 | |
| SCHEMBL7163689 | 0.81 | ITGB3 (0.48) | ITGB3ITGAVALDH1A1TSHRCYP3A4 | |
| SCHEMBL7164959 | 0.81 | MMP2 (0.51) | ITGB3MMP2MMP9IDO1TDO2 |
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 |