Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 1/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.50 |
| ▸ | PARP1 | P09874 | 1/20 | 0.46 |
| ▸ | SRC | P12931 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.42 |
| ▸ | NAMPT | P43490 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 2/20 | 0.41 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.40 |
| ▸ | IKBKB | O14920 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8458647 | 0.80 | ADRA2A (0.57) | ADRA2AADRA1APARP1HPGDLMNA | |
| SCHEMBL10780272 | 0.78 | ADRA2A (0.52) | ADRA2AADRA1APARP1SRCHPGD | |
| SCHEMBL27220771 | 0.77 | ADRA2A (0.51) | ADRA2AADRA1APARP1HPGDLMNA | |
| SCHEMBL30346675 | 0.75 | ADRA2A (0.42) | ADRA2AADRA1APARP1SRCHPGD | |
| SCHEMBL27220770 | 0.75 | ADRA2A (0.42) | ADRA2AADRA1APARP1SRCHPGD | |
| SCHEMBL12569386 | 0.75 | HTR6 (0.64) | ADRA2AADRA1APARP1HPGDLMNA | |
| SCHEMBL20782198 | 0.75 | ADRA2A (0.52) | ADRA2AADRA1APARP1HPGDLMNA | |
| SCHEMBL10750303 | 0.75 | PTPN1 (0.52) | ADRA2AADRA1APARP1HPGDLMNA | |
| SCHEMBL22220775 | 0.74 | CA2 (0.47) | ADRA2AADRA1APARP1HPGDLMNA | |
| SCHEMBL2965194 | 0.74 | PNMT (0.47) | ADRA1AHPGDLMNAAR |
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-117813288-A | Arylamino derivative estrogen receptor modulator and use thereof | 西藏海思科制药有限公司 | 2024-04-02 | — | — | CN | disclosed |