Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2B6 | P20813 | 1/20 | 0.38 |
| ▸ | TENT4A | Q5XG87 | 1/20 | 0.38 |
| ▸ | TENT4B | Q8NDF8 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | LNPEP | Q9UIQ6 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4970456 | 0.86 | MEN1 (0.37) | CYP2B6TENT4ATENT4BKDM4EALDH1A1 | |
| SCHEMBL1006237 | 0.82 | CYP2C9 (0.45) | KDM4EALDH1A1TDP1CYP2C9NPC1 | |
| SCHEMBL1006239 | 0.82 | CYP2C9 (0.45) | KDM4EALDH1A1TDP1CYP2C9NPC1 | |
| SCHEMBL811262 | 0.82 | CYP2C9 (0.45) | KDM4EALDH1A1TDP1CYP2C9NPC1 | |
| SCHEMBL4196205 | 0.81 | CYP2B6 (0.33) | CYP2B6TENT4ATENT4B | |
| SCHEMBL4196189 | 0.76 | FDPS (0.47) | ALDH1A1CYP2C9NPC1RAB9ANPSR1 | |
| SCHEMBL21327180 | 0.74 | CYP2B6 (0.37) | CYP2B6TENT4ATENT4BLNPEPSMN1; SMN2 | |
| SCHEMBL29714684 | 0.74 | CYP2B6 (0.37) | CYP2B6TENT4ATENT4BLNPEPSMN1; SMN2 | |
| SCHEMBL4193747 | 0.71 | PPARA (0.38) | CYP2B6TENT4ATENT4B | |
| SCHEMBL14114918 | 0.71 | TUBB1 (0.45) | KDM4EALDH1A1TDP1CYP2C9NPC1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008113835-A9 | PROCESS FOR PREPARING (R OR S)-5-{1-AZIDO-3-[6-METHOXY-5-(3-METHOXY-PROPOXY)-PYRIDIN-3-YLMETHYL]-4-METHYL-PENTYL}-3-ALKYL-DIHYDRO-FURAN-2-ONE | SPEEDEL EXPERIMENTA AG (CH) | 2009-02-19 | — | — | WO | disclosed |
| WO-2008113835-A1 | PROCESS FOR PREPARING (R OR S)-5-{1-AZIDO-3-[6-METHOXY-5-(3-METHOXY-PROPOXY)-PYRIDIN-3-YLMETHYL]-4-METHYL-PENTYL}-3-ALKYL-DIHYDRO-FURAN-2-ONE | NOVARTIS AG (CH) | 2008-09-25 | — | — | WO | disclosed |
| WO-2008113835-A1 | PROCESS FOR PREPARING (R OR S)-5-{1-AZIDO-3-[6-METHOXY-5-(3-METHOXY-PROPOXY)-PYRIDIN-3-YLMETHYL]-4-METHYL-PENTYL}-3-ALKYL-DIHYDRO-FURAN-2-ONE | NOVARTIS AG (CH) | 2008-09-25 | — | — | WO | disclosed |
| WO-2008113835-A1 | PROCESS FOR PREPARING (R OR S)-5-{1-AZIDO-3-[6-METHOXY-5-(3-METHOXY-PROPOXY)-PYRIDIN-3-YLMETHYL]-4-METHYL-PENTYL}-3-ALKYL-DIHYDRO-FURAN-2-ONE | NOVARTIS AG (CH) | 2008-09-25 | — | — | WO | disclosed |