Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.40 |
| ▸ | VNN1 | O95497 | 4/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | FDPS | P14324 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | HRH1 | P35367 | 1/20 | 0.30 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18642985 | 0.76 | CTDSP1 (0.58) | CTDSP1CYP1A2P2RX7VNN1CYP2C9 | |
| SCHEMBL1911593 | 0.75 | CTDSP1 (0.41) | CTDSP1CYP1A2P2RX7VNN1CYP2C9 | |
| Acetic Acid SCHEMBL23877896 | 0.74 | CYP1A2 (0.53) | CTDSP1CYP1A2P2RX7VNN1CYP2C9 | |
| Acetic Acid SCHEMBL28021481 | 0.73 | CYP1A2 (0.51) | CTDSP1CYP1A2P2RX7VNN1CYP2C9 | |
| SCHEMBL27883898 | 0.72 | CYP1A2 (0.50) | CTDSP1CYP1A2P2RX7VNN1CYP2C9 | |
| SCHEMBL18624749 | 0.71 | CTDSP1 (0.54) | CTDSP1CYP1A2P2RX7VNN1CYP2C9 | |
| Acetic Acid SCHEMBL28021480 | 0.71 | CTDSP1 (0.54) | CTDSP1CYP1A2P2RX7VNN1CYP2C9 | |
| SCHEMBL8230937 | 0.71 | NPSR1 (0.62) | CTDSP1CYP1A2P2RX7VNN1CYP2C9 | |
| SCHEMBL14167452 | 0.70 | CYP1A2 (0.57) | CTDSP1CYP1A2P2RX7VNN1CYP2C9 | |
| SCHEMBL12530365 | 0.70 | CTDSP1 (0.49) | CTDSP1CYP1A2P2RX7VNN1CYP2C9 |
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-116075497-A | Composite forms of tetraacetylethylene diamine | 一星解决方案有限公司 | 2023-05-05 | — | — | CN | disclosed |