Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 9/20 | 0.62 |
| ▸ | RAB9A | P51151 | 9/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.50 |
| ▸ | RELA | Q04206 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL23401411 | 0.88 | NPC1 (0.68) | NPC1RAB9ASMN1; SMN2KMT2AMEN1 | |
| SCHEMBL23401483 | 0.88 | NPC1 (0.59) | NPC1RAB9ASMN1; SMN2KMT2AHSP90AA1 | |
| SCHEMBL23401657 | 0.84 | NPC1 (0.70) | NPC1RAB9ASMN1; SMN2KMT2ANFKB1 | |
| SCHEMBL23402767 | 0.84 | NPC1 (0.58) | NPC1RAB9ASMN1; SMN2KMT2ANFKB1 | |
| SCHEMBL23402631 | 0.81 | CA1 (0.47) | NPC1RAB9ASMN1; SMN2KMT2AHSP90AA1 | |
| SCHEMBL23399941 | 0.79 | CYP17A1 (0.46) | NPC1RAB9AKMT2AHIF1ALMNA | |
| SCHEMBL7912407 | 0.78 | NPC1 (0.65) | NPC1RAB9ASMN1; SMN2KMT2AHSP90AA1 | |
| SCHEMBL23399647 | 0.78 | RAB9A (0.55) | NPC1RAB9ASMN1; SMN2KMT2AMEN1 | |
| SCHEMBL23399939 | 0.78 | ALDH1A1 (0.47) | NPC1RAB9ASMN1; SMN2KMT2AHSP90AA1 | |
| SCHEMBL8766069 | 0.78 | NPC1 (0.54) | NPC1RAB9ASMN1; SMN2KMT2AHSP90AA1 |
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 |