Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 5/20 | 0.52 |
| ▸ | NPC1 | O15118 | 4/20 | 0.52 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 6/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | KIF11 | P52732 | 1/20 | 0.39 |
| ▸ | PSMB8 | P28062 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11819605 | 0.84 | NPC1 (0.49) | POLBNPC1PIN1ALDH1A1MAPT | |
| SCHEMBL29306845 | 0.82 | NPC1 (0.41) | POLBNPC1PIN1ALDH1A1MAPT | |
| SCHEMBL28700964 | 0.81 | NPC1 (0.36) | POLBNPC1PIN1ALDH1A1MAPT | |
| SCHEMBL30679840 | 0.81 | NPC1 (0.36) | POLBNPC1PIN1ALDH1A1MAPT | |
| SCHEMBL22444956 | 0.80 | ALDH1A1 (0.38) | POLBNPC1PIN1ALDH1A1MAPT | |
| SCHEMBL11937233 | 0.79 | ALDH1A1 (0.63) | POLBNPC1PIN1ALDH1A1MAPT | |
| SCHEMBL11425123 | 0.78 | POLB (0.56) | POLBNPC1PIN1ALDH1A1MAPT | |
| SCHEMBL1310721 | 0.78 | PTPN1 (0.55) | POLBNPC1PIN1ALDH1A1KDM4E | |
| SCHEMBL11420376 | 0.77 | POLB (0.52) | POLBNPC1PIN1ALDH1A1MAPT | |
| SCHEMBL10014193 | 0.77 | PIN1 (0.61) | POLBNPC1PIN1ALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-114478601-B | Condensed ring compound containing boron atom, nitrogen atom and selenium atom or tellurium atom, and organic electroluminescent device | 中国科学院长春应用化学研究所 | 2024-03-29 | — | — | CN | disclosed |