Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DCUN1D1 | Q96GG9 | 2/20 | 0.39 |
| ▸ | DCUN1D2 | Q6PH85 | 1/20 | 0.39 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | LTK | P29376 | 2/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.36 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | CSF1R | P07333 | 1/20 | 0.36 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.36 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.36 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.36 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.36 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.36 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.36 |
| ▸ | AKT1 | P31749 | 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 | |
|---|---|---|---|---|
| SCHEMBL6693198 | 0.96 | DCUN1D1 (0.41) | DCUN1D1DCUN1D2NISCHLTKCLK4 | |
| SCHEMBL9089922 | 0.85 | SYK (0.39) | NISCHALDH1A1HPGDMAPK1METAP2 | |
| SCHEMBL16800868 | 0.79 | CYP1A2 (0.45) | AKT1AKT2ALDH1A1ALOX15MAPK1 | |
| SCHEMBL9438 | 0.79 | CYP1A2 (0.48) | NISCHAKT1AKT2ALDH1A1ALOX15 | |
| SCHEMBL27753863 | 0.77 | ALDH1A1 (0.40) | ALDH1A1CYP2A6ADORA3CDK8POLB | |
| SCHEMBL31519384 | 0.77 | CYP1A2 (0.47) | NISCHAKT1AKT2ALDH1A1ALOX15 | |
| SCHEMBL30636164 | 0.77 | CYP1A2 (0.47) | NISCHAKT1AKT2ALDH1A1ALOX15 | |
| Ammonia Solution, Strong SCHEMBL29843017 | 0.77 | CYP1A2 (0.47) | CLK4DYRK1BPDGFRALIMK1CDK5 | |
| SCHEMBL842040 | 0.77 | CYP1A2 (0.47) | NISCHAKT1AKT2ALDH1A1ALOX15 | |
| SCHEMBL28309054 | 0.77 | CYP1A2 (0.47) | AKT1AKT2ALDH1A1ALOX15HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108467365-B | IDO enzyme inhibitor compound and preparation method and application thereof | 郑州工程技术学院 | 2021-05-04 | — | — | CN | claimed |
| CN-108467365-B | IDO enzyme inhibitor compound and preparation method and application thereof | 郑州工程技术学院 | 2021-05-04 | — | — | CN | disclosed |
| CN-108467365-B | IDO enzyme inhibitor compound and preparation method and application thereof | 郑州工程技术学院 | 2021-05-04 | — | — | CN | disclosed |