Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.57 |
| ▸ | RAB9A | P51151 | 5/20 | 0.57 |
| ▸ | CTSL | P07711 | 3/20 | 0.56 |
| ▸ | CTSB | P07858 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 4/20 | 0.56 |
| ▸ | TP53 | P04637 | 4/20 | 0.56 |
| ▸ | HPGD | P15428 | 3/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | STAT1 | P42224 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | CASP1 | P29466 | 1/20 | 0.54 |
| ▸ | CASP7 | P55210 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL7135274 | 0.84 | MAOB (0.61) | NPC1RAB9AALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL30382984 | 0.84 | NPC1 (0.56) | NPC1RAB9ACTSLCTSBALDH1A1 | |
| Water SCHEMBL5011619 | 0.82 | MAOB (0.60) | NPC1RAB9AALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL14982108 | 0.80 | NPC1 (0.82) | NPC1RAB9AALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL2975193 | 0.80 | NPC1 (0.82) | NPC1RAB9AALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL17737071 | 0.79 | ALDH1A1 (0.67) | NPC1RAB9AALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL13850382 | 0.79 | ALDH1A1 (0.67) | NPC1RAB9AALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL65682 | 0.79 | ALDH1A1 (0.67) | NPC1RAB9AALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL4652266 | 0.78 | CTSL (0.57) | NPC1RAB9ACTSLCTSBALDH1A1 | |
| SCHEMBL24620616 | 0.78 | NPC1 (0.85) | NPC1RAB9ACTSLCTSBALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116768917-A | Organic micromolecular light absorber and preparation method and application thereof | 常州大学 | 2023-09-19 | — | — | CN | disclosed |
| CN-110963935-A | 1-phenyl-2-aminoacetophenone derivative and medical application thereof | 中国人民解放军军事科学院军事医学研究院 | 2020-04-07 | — | — | CN | disclosed |
| WO-2014106763-A1 | PYRIDOPYRAZINES AS ANTICANCER AGENTS | VICHEM CHEMIE KUTATÓ KFT. (HU) | 2014-07-10 | — | — | WO | disclosed |