Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 3/20 | 0.44 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | RORC | P51449 | 1/20 | 0.39 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19486854 | 0.84 | SIGMAR1 (0.47) | ALDH1A1TDP1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL26893117 | 0.84 | SIGMAR1 (0.47) | ALDH1A1TDP1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL28290433 | 0.80 | KDM4E (0.55) | CHRNB2CHRNA4TP53MDM2CHRM2 | |
| SCHEMBL27930152 | 0.78 | CHRNB2 (0.46) | CHRNB2CHRNA4TP53MDM2CHRM2 | |
| SCHEMBL4629587 | 0.77 | CHRNB2 (0.44) | CHRNB2CHRNA4TP53MDM2CHRM2 | |
| SCHEMBL31297402 | 0.77 | TDP1 (0.33) | TDP1 | |
| SCHEMBL4900649 | 0.76 | KDM4E (0.51) | CHRNB2CHRNA4TP53MDM2KDM4E | |
| Trifluoroacetic Acid SCHEMBL26697682 | 0.75 | MITF (0.40) | ALDH1A1SLC6A2SLC6A4 | |
| SCHEMBL209069 | 0.71 | CHRNB2 (0.72) | CHRNB2CHRNA4KDM4EALDH1A1TDP1 | |
| SCHEMBL31256877 | 0.71 | CHRNB2 (0.72) | CHRNB2CHRNA4KDM4EALDH1A1TDP1 |
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-119143734-A | Heterocyclic compounds as AT2R antagonists and uses thereof | 武汉人福创新药物研发中心有限公司 | 2024-12-17 | — | — | CN | disclosed |