Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 3/20 | 0.35 |
| ▸ | CNR2 | P34972 | 3/20 | 0.35 |
| ▸ | FAAH | O00519 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TPSAB1 | Q15661 | 2/20 | 0.32 |
| ▸ | TPSD1 | Q9BZJ3 | 2/20 | 0.32 |
| ▸ | TPSG1 | Q9NRR2 | 2/20 | 0.32 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.32 |
| ▸ | FPR2 | P25090 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | GSR | P00390 | 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 | |
|---|---|---|---|---|
| SCHEMBL9499570 | 0.87 | TDP1 (0.39) | TDP1CNR1CNR2FAAHALDH1A1 | |
| SCHEMBL9498033 | 0.87 | TDP1 (0.39) | TDP1CNR1CNR2FAAHALDH1A1 | |
| SCHEMBL9795106 | 0.87 | TDP1 (0.39) | TDP1CNR1CNR2FAAHALDH1A1 | |
| SCHEMBL9795460 | 0.84 | TDP1 (0.41) | TDP1CNR1CNR2FAAHALDH1A1 | |
| SCHEMBL9795326 | 0.84 | TDP1 (0.61) | TDP1ALDH1A1TPSAB1TPSD1TPSG1 | |
| SCHEMBL9127901 | 0.84 | FAAH (0.35) | TDP1CNR1CNR2FAAHALDH1A1 | |
| SCHEMBL9130578 | 0.82 | TDP1 (0.38) | TDP1CNR1CNR2FAAHALDH1A1 | |
| SCHEMBL6938019 | 0.82 | TDP1 (0.59) | TDP1CNR1CNR2FAAHALDH1A1 | |
| SCHEMBL9795351 | 0.81 | FAAH (0.35) | TDP1CNR1CNR2FAAHALDH1A1 | |
| SCHEMBL9499610 | 0.81 | FAAH (0.35) | TDP1CNR1CNR2FAAHALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0515420-B1 | NITRIC ACID ESTERS OF CYCLOHEXANOL DERIVATIVES | BOEHRINGER MANNHEIM GMBH (DE) | 1996-06-12 | — | — | EP | claimed |
| US-5411989-A | Cardiovascular disorders | BOEHRINGER MANNHEIM, GMBH (DE) | 1995-05-02 | — | — | US | claimed |
| US-5411989-A | Cardiovascular disorders | BOEHRINGER MANNHEIM, GMBH (DE) | 1995-05-02 | — | — | US | disclosed |