Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28505333 | 1.00 | KDM4E (0.37) | KDM4EPOLBNOS3NOS1NOS2 | |
| SCHEMBL28268990 | 0.89 | NR3C1 (0.33) | KDM4EPOLBNOS3NOS1NOS2 | |
| SCHEMBL28268987 | 0.89 | NR3C1 (0.33) | KDM4EPOLBNOS3NOS1NOS2 | |
| SCHEMBL28868399 | 0.86 | SIGMAR1 (0.39) | SIGMAR1KCNH2MAOB | |
| SCHEMBL28868398 | 0.86 | SIGMAR1 (0.39) | SIGMAR1KCNH2MAOB | |
| SCHEMBL28267269 | 0.85 | DRD2 (0.39) | KCNH2 | |
| SCHEMBL28267271 | 0.85 | DRD2 (0.39) | KCNH2 | |
| SCHEMBL28269000 | 0.84 | TAAR1 (0.39) | KDM4EPOLBGAAALOX12HTT | |
| SCHEMBL28268996 | 0.84 | TAAR1 (0.39) | KDM4EPOLBGAAALOX12HTT | |
| SCHEMBL28267457 | 0.80 | SIGMAR1 (0.38) | KDM4ESIGMAR1HTTKCNH2 |
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-109111333-B | Chiral gem-disilyl alkane compound and synthesis method and application thereof | 浙江大学 | 2021-01-08 | — | — | CN | disclosed |