Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 2/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | GPR119 | Q8TDV5 | 6/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.34 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | BCR | P11274 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 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 | |
|---|---|---|---|---|
| SCHEMBL29455208 | 0.83 | ENPP2 (0.40) | TACR1KCNH2 | |
| SCHEMBL28559237 | 0.83 | ENPP2 (0.40) | TACR1KCNH2 | |
| SCHEMBL29455198 | 0.81 | TACR1 (0.40) | TACR1KCNH2SCN5ASCN9ANAMPT | |
| SCHEMBL29455217 | 0.81 | SSTR4 (0.44) | TACR1GPR119KCNH2SCN5ASCN9A | |
| SCHEMBL29455199 | 0.78 | GPR119 (0.39) | PARP1GPR119NAMPT | |
| SCHEMBL28560616 | 0.78 | KDM4E (0.36) | PARP1GPR119NAMPTROCK2 | |
| SCHEMBL29455207 | 0.78 | KDM4E (0.36) | PARP1GPR119NAMPTROCK2 | |
| SCHEMBL29455214 | 0.75 | GNRHR (0.34) | PARP1ROCK2 | |
| SCHEMBL17112620 | 0.71 | KCNK3 (0.42) | GPR119NAMPT | |
| SCHEMBL17112622 | 0.71 | KCNK3 (0.42) | GPR119NAMPT |
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-112778274-B | Nitrogen-containing heterocyclic derivative and preparation thereof | 四川海思科制药有限公司 | 2022-02-15 | — | — | CN | disclosed |