Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCF1 | P14598 | 3/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | PRKDC | P78527 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 2/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5911169 | 0.84 | NCF1 (0.63) | NCF1CYP1A2HIF1ALMNAPTK2 | |
| SCHEMBL3756442 | 0.81 | NCF1 (0.56) | NCF1CYP1A2HIF1ALMNAPTK2 | |
| SCHEMBL484168 | 0.80 | AR (0.47) | NCF1CYP1A2LMNAL3MBTL1POLB | |
| SCHEMBL9697066 | 0.79 | NCF1 (0.58) | NCF1CYP1A2HIF1ALMNAPTK2 | |
| SCHEMBL5943623 | 0.79 | NCF1 (0.58) | NCF1CYP1A2HIF1ALMNAPTK2 | |
| SCHEMBL3537180 | 0.79 | POLB (0.48) | L3MBTL1POLBTDP1PRKDCNOS2 | |
| Iodide SCHEMBL28842235 | 0.78 | NCF1 (0.56) | NCF1CYP1A2HIF1ALMNAPTK2 | |
| SCHEMBL6602116 | 0.78 | NCF1 (0.56) | NCF1CYP1A2HIF1ALMNAPTK2 | |
| SCHEMBL6609697 | 0.77 | NCF1 (0.54) | NCF1CYP1A2HIF1ALMNAPTK2 | |
| SCHEMBL4263734 | 0.77 | NCF1 (1.00) | NCF1CYP1A2HIF1ALMNAPTK2 |
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-1412349-A2 | PIPERAZINE OXYQUINOLINE (NAPHTHALINE) PLATELET ADENOSINE DIPHOSPHATE RECEPTOR ANTAGONISTS | Schering Aktiengesellschaft (DE) | 2004-04-28 | — | — | EP | disclosed |
| WO-2002098856-A2 | PIPERAZINE OXYQUINOLINE (NAPHTHALINE) PLATELET ADENOSINE DIPHOSPHATE RECEPTOR ANTAGONISTS | SCHERING AKTIENGESELLSCHAFT (DE) | 2002-12-12 | — | — | WO | disclosed |