Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NNMT | P40261 | 3/20 | 0.43 |
| ▸ | TGFBR1 | P36897 | 4/20 | 0.39 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.39 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.37 |
| ▸ | IKBKB | O14920 | 2/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.35 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.34 |
| ▸ | PDE2A | O00408 | 1/20 | 0.34 |
| ▸ | PDE5A | O76074 | 1/20 | 0.34 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.34 |
| ▸ | PDE11A | Q9HCR9 | 1/20 | 0.34 |
| ▸ | F7 | P08709 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30362845 | 0.78 | NNMT (0.54) | NNMTTGFBR1IKBKBPARP1PDGFRB | |
| SCHEMBL31374321 | 0.75 | PDE4B (0.38) | TGFBR1PARP1PDE10APDE11A | |
| SCHEMBL30362795 | 0.74 | KDM4C (0.39) | TGFBR1IMPDH2IMPDH1IKBKBPARP1 | |
| SCHEMBL30362816 | 0.72 | CSNK1A1 (0.42) | TGFBR1PARP1MKNK1MKNK2 | |
| Hydrochloric Acid SCHEMBL30363062 | 0.71 | CSNK1A1 (0.41) | TGFBR1PARP1MKNK1MKNK2 | |
| SCHEMBL14358203 | 0.71 | NNMT (0.54) | NNMTPLAUIKBKBPARP1PDE10A | |
| SCHEMBL28251194 | 0.71 | NNMT (0.54) | NNMTPLAUIKBKBPOLBTDP1 | |
| SCHEMBL3341732 | 0.69 | NNMT (0.53) | NNMTPLAUIKBKBPARP1PDE10A | |
| SCHEMBL30362791 | 0.69 | IKBKB (0.40) | TGFBR1IMPDH2IMPDH1PLAUIKBKB | |
| SCHEMBL30533104 | 0.69 | TGFBR1 (0.36) | TGFBR1IKBKBPARP1 |
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-114127080-B | Heterocyclic compounds as kinase inhibitors, compositions comprising the same, and methods of use thereof | 捷思英达医药技术（上海）有限公司 | 2023-05-05 | — | — | CN | claimed |
| CN-114127080-B | Heterocyclic compounds as kinase inhibitors, compositions comprising the same, and methods of use thereof | 捷思英达医药技术（上海）有限公司 | 2023-05-05 | — | — | CN | disclosed |