Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.48 |
| ▸ | ALPI | P09923 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | XIAP | P98170 | 1/20 | 0.47 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.46 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8059246 | 0.89 | HDAC8 (0.48) | HDAC8ALPIPKMPTGS1XIAP | |
| SCHEMBL8065026 | 0.87 | POLB (0.54) | HDAC8ALPIPKMPTGS1XIAP | |
| SCHEMBL10491053 | 0.85 | KMT2A (0.59) | HDAC8ALPIPKMPTGS1XIAP | |
| SCHEMBL6161206 | 0.81 | HDAC8 (0.66) | HDAC8ALPIPKMPTGS1XIAP | |
| SCHEMBL28820471 | 0.79 | SLC7A5 (0.68) | HDAC8ALPIPKMPTGS1XIAP | |
| SCHEMBL8835936 | 0.79 | SLC7A5 (0.68) | HDAC8ALPIPKMPTGS1XIAP | |
| SCHEMBL288607 | 0.79 | SLC7A5 (0.68) | HDAC8ALPIPKMPTGS1XIAP | |
| SCHEMBL2908042 | 0.78 | TSHR (0.63) | HDAC8L3MBTL1KMT2AOPRD1ALDH1A1 | |
| SCHEMBL30337959 | 0.78 | TSHR (0.63) | HDAC8L3MBTL1KMT2AOPRD1ALDH1A1 | |
| SCHEMBL13087400 | 0.78 | ALPI (0.61) | HDAC8ALPIPKMPTGS1XIAP |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1000051-A1 | CARBAMYLOXY COMPOUNDS WHICH INHIBIT LEUKOCYTE ADHESION MEDIATED BY VLA-4 | Elan Pharmaceuticals, Inc. (US) | 2000-05-17 | — | — | EP | disclosed |
| WO-1999006390-A1 | CARBAMYLOXY COMPOUNDS WHICH INHIBIT LEUKOCYTE ADHESION MEDIATED BY VLA-4 | ELAN PHARMACEUTICALS, INC. (US) | 1999-02-11 | — | — | WO | disclosed |