Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.35 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 4/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28855634 | 0.84 | TP53 (0.48) | TP53LMNAMAPK1CA2CA1 | |
| SCHEMBL23296192 | 0.82 | KDM4E (0.36) | TP53TDP1TSHRCYP3A4NFKB1 | |
| SCHEMBL28933614 | 0.79 | EPHX1 (0.41) | TSHRKDM4EGAACYP2C19SMN1; SMN2 | |
| SCHEMBL5154817 | 0.77 | HDAC7 (0.43) | TP53HDAC7HDAC8HDAC6HDAC9 | |
| SCHEMBL7028930 | 0.77 | HDAC7 (0.38) | TP53HDAC7HDAC8HDAC6HDAC9 | |
| SCHEMBL11514498 | 0.76 | TP53 (0.38) | TP53HDAC7HDAC8HDAC6HDAC9 | |
| SCHEMBL7032509 | 0.76 | HDAC7 (0.37) | TP53HDAC7HDAC8HDAC6HDAC9 | |
| SCHEMBL21474430 | 0.74 | ANPEP (0.30) | — | |
| SCHEMBL28890999 | 0.72 | ADH1B (0.38) | TP53HDAC7HDAC8HDAC6HDAC9 | |
| SCHEMBL21623888 | 0.71 | CA2 (0.40) | TP53HDAC7HDAC8HDAC6HDAC9 |
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-110396165-B | Ionically hydrophilicized polyisocyanates and antioxidants | 科思创德国股份有限公司 | 2022-12-06 | — | — | CN | disclosed |