Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 4/20 | 0.39 |
| ▸ | CA1 | P00915 | 4/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.38 |
| ▸ | CA9 | Q16790 | 3/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CKS1B | P61024 | 1/20 | 0.37 |
| ▸ | SKP1 | P63208 | 1/20 | 0.37 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27518163 | 0.86 | TDP1 (0.46) | TDP1MEN1GAAKMT2AMAOA | |
| SCHEMBL270450 | 0.78 | TDP1 (0.51) | TDP1MEN1GAAKMT2AMAOA | |
| SCHEMBL262217 | 0.78 | MEN1 (0.46) | TDP1MEN1GAAKMT2AMAOA | |
| SCHEMBL25531030 | 0.77 | TDP1 (0.50) | TDP1MEN1GAAKMT2AMAOA | |
| SCHEMBL12482641 | 0.76 | TDP1 (0.56) | TDP1MEN1GAAKMT2AMAOA | |
| SCHEMBL25963695 | 0.75 | TDP1 (0.45) | TDP1MEN1GAAKMT2AMAOA | |
| SCHEMBL13055395 | 0.74 | TDP1 (0.55) | TDP1MEN1GAAKMT2AMAOA | |
| SCHEMBL1979026 | 0.74 | TDP1 (0.55) | TDP1MEN1GAAKMT2AMAOA | |
| SCHEMBL13055580 | 0.74 | TDP1 (0.47) | TDP1MEN1GAAKMT2AMAOA | |
| SCHEMBL13366914 | 0.74 | MEN1 (0.45) | TDP1MEN1GAAKMT2AMAOA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3978498-A1 | SUBSTITUTED FUSED BICYCLIC DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF IN MEDICINES | Jiangsu Hengrui Medicine Co., Ltd. (CN) | 2022-04-06 | — | — | EP | disclosed |
| WO-2020238776-A1 | SUBSTITUTED FUSED BICYCLIC DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF IN MEDICINES | 江苏恒瑞医药股份有限公司 | 2020-12-03 | — | — | WO | disclosed |