Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.50 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.50 |
| ▸ | PI4KA | P42356 | 4/20 | 0.50 |
| ▸ | PI4K2B | Q8TCG2 | 4/20 | 0.50 |
| ▸ | PI4K2A | Q9BTU6 | 4/20 | 0.50 |
| ▸ | PI4KB | Q9UBF8 | 4/20 | 0.50 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.50 |
| ▸ | GSK3B | P49841 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 2/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | ADCY5 | O95622 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | THPO | P40225 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7278435 | 1.00 | ALDH1A1 (0.51) | ALDH1A1ADORA2AADORA1PI4KAPI4K2B | |
| SCHEMBL28004601 | 0.82 | ADORA2A (0.58) | ADORA2AADORA1PI4KAPI4K2BPI4K2A | |
| SCHEMBL28210687 | 0.77 | ADORA2A (0.51) | ALDH1A1ADORA2AADORA1PI4KAPI4K2B | |
| SCHEMBL48132 | 0.75 | ADORA2A (0.67) | ALDH1A1ADORA2AADORA1PI4KAPI4K2B | |
| SCHEMBL9621206 | 0.75 | GSK3B (0.50) | ALDH1A1ADORA2AADORA1PI4KAPI4K2B | |
| SCHEMBL9120 | 0.74 | ADORA2A (0.59) | ADORA2AADORA1PI4KAPI4K2BPI4K2A | |
| SCHEMBL28187328 | 0.73 | FDPS (0.41) | ALDH1A1CYP3A4CYP1A2 | |
| SCHEMBL6532875 | 0.72 | ALDH1A1 (0.73) | ALDH1A1ADORA2AADORA1PI4KAPI4K2B | |
| SCHEMBL5049210 | 0.72 | ADORA2A (0.63) | ALDH1A1ADORA2AADORA1PI4KAPI4K2B | |
| SCHEMBL22399264 | 0.72 | ADORA2A (0.56) | ADORA2AADORA1PI4KAPI4K2BPI4K2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107365352-A | A kind of new tripeptide compound for containing 9 adenine alanine and its preparation method and application | 河南师范大学 | 2017-11-21 | — | — | CN | claimed |
| CN-106083856-A | A kind of purines alanine derivatives that can be used for oncotherapy and its preparation method and application | 河南师范大学 | 2016-11-09 | — | — | CN | claimed |
| CN-107365352-A | A kind of new tripeptide compound for containing 9 adenine alanine and its preparation method and application | 河南师范大学 | 2017-11-21 | — | — | CN | disclosed |
| CN-106083856-A | A kind of purines alanine derivatives that can be used for oncotherapy and its preparation method and application | 河南师范大学 | 2016-11-09 | — | — | CN | disclosed |
| EP-0048159-A2 | Novel carboxyalkyl peptides and thioethers and ethers of peptides as antihypertensive agents | UNIVERSITY OF MIAMI (US) | 1982-03-24 | — | — | EP | disclosed |