Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.53 |
| ▸ | MAPK10 | P53779 | 6/20 | 0.44 |
| ▸ | TDO2 | P48775 | 1/20 | 0.43 |
| ▸ | FLT3 | P36888 | 3/20 | 0.43 |
| ▸ | ABL1 | P00519 | 2/20 | 0.43 |
| ▸ | BCR | P11274 | 2/20 | 0.43 |
| ▸ | KIT | P10721 | 2/20 | 0.43 |
| ▸ | FLT4 | P35916 | 2/20 | 0.43 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.43 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.43 |
| ▸ | CDKL3 | Q8IVW4 | 1/20 | 0.43 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.43 |
| ▸ | SYK | P43405 | 1/20 | 0.41 |
| ▸ | MAPK8 | P45983 | 3/20 | 0.41 |
| ▸ | KDR | P35968 | 2/20 | 0.41 |
| ▸ | SETD7 | Q8WTS6 | 1/20 | 0.41 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.41 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 2/20 | 0.41 |
| ▸ | CDC7 | O00311 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29968183 | 1.00 | NR1H4 (0.53) | NR1H4MAPK10TDO2FLT3ABL1 | |
| SCHEMBL28871266 | 0.92 | NR1H4 (0.45) | NR1H4TDO2FLT3ABL1BCR | |
| SCHEMBL29967985 | 0.92 | NR1H4 (0.45) | NR1H4TDO2FLT3ABL1BCR | |
| SCHEMBL29968363 | 0.90 | MAPK10 (0.54) | MAPK10TDO2FLT3ABL1BCR | |
| SCHEMBL28871255 | 0.90 | MAPK10 (0.54) | MAPK10TDO2FLT3ABL1BCR | |
| SCHEMBL29968242 | 0.90 | NR1H4 (0.48) | NR1H4MAPK10FLT3ABL1BCR | |
| SCHEMBL28871272 | 0.90 | NR1H4 (0.48) | NR1H4MAPK10FLT3ABL1BCR | |
| SCHEMBL28871315 | 0.89 | MAPK1 (0.48) | MAPK10TDO2FLT3KITFLT4 | |
| SCHEMBL29967504 | 0.88 | NR1H4 (0.44) | NR1H4MAPK10FLT3ABL1BCR | |
| SCHEMBL28871209 | 0.86 | KDR (0.41) | MAPK10FLT3ABL1BCRKIT |
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-115260165-A | Benzo nitrogen-containing five-membered heterocyclic compound and synthesis and application thereof | 中国科学院上海药物研究所 | 2022-11-01 | — | — | CN | disclosed |