Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | KLK7 | P49862 | 2/20 | 0.40 |
| ▸ | KLK5 | Q9Y337 | 2/20 | 0.40 |
| ▸ | CCKAR | P32238 | 1/20 | 0.40 |
| ▸ | CCKBR | P32239 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.39 |
| ▸ | ITGAV | P06756 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TACR1 | P25103 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7164260 | 0.91 | TSHR (0.42) | MAPTCCKARCCKBRPOLBTHRB | |
| SCHEMBL7478067 | 0.88 | PTPN1 (0.44) | MAPTKDM4ETDP1KLK7KLK5 | |
| SCHEMBL7363237 | 0.86 | CCKAR (0.44) | MAPTKDM4ETDP1KLK7KLK5 | |
| SCHEMBL7365578 | 0.85 | THRB (0.42) | MAPTMAPK1THRBTSHRHSD17B10 | |
| SCHEMBL7472452 | 0.85 | THRB (0.39) | MAPTMAPK1THRBITGB3TSHR | |
| SCHEMBL7369546 | 0.85 | THRB (0.39) | MAPTMAPK1THRBITGB3ITGAV | |
| SCHEMBL4850590 | 0.85 | CCKAR (0.35) | MAPTCCKARCCKBRPOLBTHRB | |
| SCHEMBL7163716 | 0.84 | ACE (0.41) | CCKARCCKBRITGB3ITGAVTSHR | |
| SCHEMBL7163504 | 0.84 | ACE (0.41) | CCKARCCKBRITGB3ITGAVTSHR | |
| SCHEMBL4683468 | 0.84 | ITGB3 (0.46) | MAPTMAPK1THRBITGB3ITGAV |
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 |