Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.37 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.36 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.36 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | CCR4 | P51679 | 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 | |
|---|---|---|---|---|
| SCHEMBL1698577 | 0.87 | KDM4E (0.52) | BRD4CYP1A2KDM4ELMNAALOX15 | |
| SCHEMBL9297586 | 0.83 | NPSR1 (0.41) | BRD4NPSR1CYP1A2ALDH1A1IRAK4 | |
| SCHEMBL24922464 | 0.82 | GRIN2D (0.35) | POLBBRD4NPSR1CYP1A2ALDH1A1 | |
| SCHEMBL1698856 | 0.81 | CYP1A2 (0.66) | POLBCYP1A2ALDH1A1KDM4ETSHR | |
| SCHEMBL12432224 | 0.80 | IRAK4 (0.49) | POLBBRD4NPSR1CYP1A2ALDH1A1 | |
| SCHEMBL522437 | 0.80 | GRIN2D (0.44) | POLBNPSR1ALDH1A1CDK5CDK5R1 | |
| SCHEMBL6898745 | 0.79 | KCNH2 (0.46) | BRD4NPSR1CYP1A2ALDH1A1IRAK4 | |
| SCHEMBL30401197 | 0.79 | NPSR1 (0.43) | BRD4NPSR1CYP1A2ALDH1A1IRAK4 | |
| SCHEMBL4859332 | 0.79 | NPSR1 (0.43) | BRD4NPSR1CYP1A2ALDH1A1IRAK4 | |
| Alcohol SCHEMBL4865562 | 0.77 | NPSR1 (0.42) | BRD4NPSR1CYP1A2ALDH1A1IRAK4 |
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-109111393-B | NNN ligand compound, cobalt-NNN complex, preparation method and application thereof | 中国科学院青岛生物能源与过程研究所 | 2021-08-27 | — | — | CN | disclosed |