Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | CDC25B | P30305 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CCR6 | P51684 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | CDC25A | P30304 | 1/20 | 0.38 |
| ▸ | CDC25C | P30307 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5214761 | 0.79 | KDM4E (0.49) | CYP1A2TSHRKDM4EALDH1A1KMT2A | |
| SCHEMBL29076964 | 0.77 | KDM4E (0.50) | MAOBMAOACYP1A2TSHRCDC25B | |
| SCHEMBL23432990 | 0.77 | HTT (0.41) | MAOBMAOACYP1A2TSHRKDM4E | |
| SCHEMBL20845567 | 0.75 | ALDH1A1 (0.49) | TSHRKDM4EALDH1A1L3MBTL1HPGD | |
| SCHEMBL30165457 | 0.74 | KDM4E (0.52) | MAOBMAOACYP1A2KDM4EALDH1A1 | |
| SCHEMBL29291542 | 0.72 | BACE1 (0.34) | ALDH1A1KMT2AHPGDNPSR1RXFP1 | |
| SCHEMBL2203246 | 0.72 | PSMD14 (0.51) | MAOBCYP1A2KDM4EKMT2AMAPK1 | |
| SCHEMBL6586612 | 0.71 | CCR6 (0.53) | CYP1A2TSHRCDC25BKDM4EALDH1A1 | |
| SCHEMBL3207023 | 0.70 | TSHR (0.59) | MAOBMAOACYP1A2TSHRCDC25B | |
| SCHEMBL954118 | 0.69 | TSHR (0.58) | MAOBMAOACYP1A2TSHRCDC25B |
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-113735844-A | 2-formyl quinoline carboxamide compound and medical application thereof | 正大天晴药业集团股份有限公司 | 2021-12-03 | — | — | CN | disclosed |
| WO-2019057053-A1 | FUSED RING DERIVATIVE USED AS FGFR4 INHIBITOR | 北京加科思益新药研发有限公司 | 2019-03-28 | — | — | WO | disclosed |