Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | NPC1 | O15118 | 4/20 | 0.57 |
| ▸ | RAB9A | P51151 | 3/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | PTPRC | P08575 | 2/20 | 0.57 |
| ▸ | NCOA1 | Q15788 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | APAF1 | O14727 | 1/20 | 0.57 |
| ▸ | TDP2 | O95551 | 1/20 | 0.57 |
| ▸ | NSD2 | O96028 | 1/20 | 0.57 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | CTSL | P07711 | 1/20 | 0.57 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.57 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.57 |
| ▸ | CTSS | P25774 | 1/20 | 0.57 |
| ▸ | NPY1R | P25929 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL30545213 | 1.00 | ALDH1A1 (0.57) | ALDH1A1NPC1RAB9ASMN1; SMN2PTPRC | |
| SCHEMBL4395100 | 1.00 | ALDH1A1 (0.57) | ALDH1A1NPC1RAB9ASMN1; SMN2PTPRC | |
| SCHEMBL16820312 | 0.95 | PTPRC (0.63) | ALDH1A1NPC1RAB9ASMN1; SMN2PTPRC | |
| SCHEMBL38924 | 0.95 | ALDH1A1 (0.56) | ALDH1A1NPC1RAB9ASMN1; SMN2PTPRC | |
| SCHEMBL4454543 | 0.95 | CYP3A4 (0.52) | ALDH1A1NPC1RAB9ASMN1; SMN2PTPRC | |
| SCHEMBL30108087 | 0.95 | ALDH1A1 (0.56) | ALDH1A1NPC1RAB9ASMN1; SMN2PTPRC | |
| SCHEMBL1099351 | 0.92 | MAOA (0.57) | ALDH1A1NPC1RAB9ASMN1; SMN2PTPRC | |
| SCHEMBL2989031 | 0.92 | MAOA (0.57) | ALDH1A1NPC1RAB9ASMN1; SMN2PTPRC | |
| SCHEMBL29634747 | 0.91 | PTPRC (0.59) | ALDH1A1NPC1RAB9ASMN1; SMN2PTPRC | |
| SCHEMBL12478792 | 0.91 | CYP3A4 (0.50) | ALDH1A1NPC1RAB9ASMN1; SMN2PTPRC |
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 |
|---|---|---|---|---|---|---|---|
| CN-116210359-A | Organic electroluminescent element | 保土谷化学工业株式会社 | 2023-06-02 | — | — | CN | disclosed |
| CN-114586189-A | Organic electroluminescent element | 保土谷化学工业株式会社 | 2022-06-03 | — | — | CN | disclosed |