Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.48 |
| ▸ | CTSD | P07339 | 3/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | NPY1R | P25929 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | BMP1 | P13497 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.40 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8121875 | 0.92 | NPY1R (0.46) | CNR2ALDH1A1KMT2ANPY1RHPGD | |
| SCHEMBL8114445 | 0.91 | NPY1R (0.48) | ALDH1A1KMT2ANPY1RHPGDCTSL | |
| SCHEMBL8128052 | 0.81 | CXCR3 (0.47) | HDAC1ALDH1A1KMT2AMEN1 | |
| SCHEMBL8123411 | 0.79 | NPY1R (0.57) | NPY1RCTSL | |
| SCHEMBL8122123 | 0.78 | HDAC1 (0.42) | HDAC1HDAC7CTSDCNR2ALDH1A1 | |
| SCHEMBL8125986 | 0.78 | NPY1R (0.60) | NPY1RCTSL | |
| SCHEMBL7151084 | 0.78 | NPY1R (0.56) | NPY1R | |
| SCHEMBL7037395 | 0.77 | NPY1R (0.60) | NPY1R | |
| SCHEMBL13804935 | 0.76 | ANPEP (0.44) | ALDH1A1NPY1RBMP1 | |
| SCHEMBL7040614 | 0.75 | NPY1R (0.57) | NPY1R |
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-0680469-B1 | AMINOACID DERIVATES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND PROCESS FOR PREPARING THE SAME | BOEHRINGER INGELHEIM PHARMA (DE) | 2000-04-26 | — | — | EP | disclosed |