Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CTSS | P25774 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | GMNN | O75496 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23401397 | 0.93 | NPC1 (0.42) | NPC1L3MBTL1CTSSCTSKTRPM8 | |
| SCHEMBL23399469 | 0.91 | CTSS (0.40) | NPC1L3MBTL1CTSSCTSKTRPM8 | |
| SCHEMBL23398511 | 0.89 | NPC1 (0.44) | NPC1L3MBTL1CTSSCTSKTRPM8 | |
| SCHEMBL23398641 | 0.88 | TP53 (0.43) | NPC1L3MBTL1CTSSCTSKTRPM8 | |
| SCHEMBL23403007 | 0.87 | CTSS (0.38) | NPC1L3MBTL1CTSSCTSKTRPM8 | |
| SCHEMBL23400272 | 0.85 | CTSS (0.41) | NPC1CTSSCTSKTRPM8TP53 | |
| SCHEMBL23399001 | 0.84 | HTR2A (0.43) | L3MBTL1TP53MAPTALDH1A1KDM4E | |
| SCHEMBL23399738 | 0.84 | TP53 (0.43) | NPC1L3MBTL1CTSSCTSKTRPM8 | |
| SCHEMBL23401100 | 0.83 | NPC1 (0.46) | NPC1L3MBTL1CTSSCTSKTRPM8 | |
| SCHEMBL23398551 | 0.83 | MAPT (0.43) | TP53MAPTALDH1A1KDM4ELMNA |
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-3828159-A1 | STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS | BASF SE (DE) | 2021-06-02 | — | — | EP | disclosed |