Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 3/20 | 0.42 |
| ▸ | CDC25B | P30305 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | CCR6 | P51684 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.41 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.41 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1180896 | 0.80 | ALDH1A1 (0.48) | AKR1C3MAPTALDH1A1POLBSMN1; SMN2 | |
| SCHEMBL2934785 | 0.79 | AKR1C3 (0.53) | AKR1C3MAPTGAAALDH1A1ATM | |
| SCHEMBL1451727 | 0.79 | AKR1C3 (0.53) | AKR1C3MAPTGAAALDH1A1ATM | |
| SCHEMBL5702899 | 0.78 | MAPT (0.58) | AKR1C3MAPTGAAALDH1A1POLB | |
| SCHEMBL29447165 | 0.75 | AKR1C3 (0.85) | AKR1C3MAPTGAAALDH1A1POLB | |
| SCHEMBL700595 | 0.75 | AKR1C3 (0.85) | AKR1C3MAPTGAAALDH1A1POLB | |
| SCHEMBL6975365 | 0.75 | KDM4E (0.34) | MAPTALDH1A1POLBSMN1; SMN2TDP1 | |
| SCHEMBL29913321 | 0.74 | AKR1C3 (0.61) | AKR1C3MAPTGAAALDH1A1POLB | |
| SCHEMBL9295747 | 0.74 | AKR1C3 (0.61) | AKR1C3MAPTGAAALDH1A1POLB | |
| SCHEMBL723657 | 0.74 | AKR1C3 (0.61) | AKR1C3MAPTGAAALDH1A1POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3052498-A1 | 3,7-DIAZABICYCLO[3.3.1]NONANE CARBOXAMIDES AS ANTITHROMBOTIC AGENTS | Council of Scientific & Industrial Research (IN) | 2016-08-10 | — | — | EP | disclosed |
| WO-2015044951-A1 | 3,7-DIAZABICYCLO[3.3.1 ]NONANE CARBOXAMIDES AS ANTITHROMBOTIC AGENTS | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2015-04-02 | — | — | WO | disclosed |