Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 4/20 | 0.37 |
| ▸ | CCND1 | P24385 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | PLAU | P00749 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29617408 | 0.82 | TSHR (0.46) | CDK4CCND1KMT2AHTR6ALDH1A1 | |
| SCHEMBL3334839 | 0.82 | TSHR (0.46) | CDK4CCND1KMT2AHTR6ALDH1A1 | |
| Cyclohexane SCHEMBL3204446 | 0.78 | TSHR (0.43) | CDK4CCND1KMT2AALDH1A1TSHR | |
| SCHEMBL28706328 | 0.75 | SLC6A2 (0.42) | CDK4CCND1GABRA1GABRA5SLC6A2 | |
| SCHEMBL30233726 | 0.72 | CDK4 (0.47) | CDK4CCND1KMT2ASLC6A2HTR6 | |
| SCHEMBL3576716 | 0.72 | CDK4 (0.47) | CDK4CCND1KMT2ASLC6A2HTR6 | |
| SCHEMBL8595609 | 0.71 | CYSLTR1 (0.50) | — | |
| SCHEMBL28197536 | 0.69 | CDK4 (0.42) | CDK4CCND1KMT2AHTR6TSHR | |
| SCHEMBL7987460 | 0.68 | CDK4 (0.42) | CDK4CCND1KMT2AHTR6PLAU | |
| SCHEMBL30233822 | 0.68 | CDK4 (0.42) | CDK4CCND1KMT2ASLC6A2HTR6 |
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-113307804-B | Synthetic method and application of fluorine-containing indole quinoline compound | 天津师范大学 | 2022-06-24 | — | — | CN | disclosed |
| CN-113307804-A | Synthetic method and application of fluorine-containing indole quinoline compound | 天津师范大学 | 2021-08-27 | — | — | CN | disclosed |