Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.51 |
| ▸ | NPC1 | O15118 | 7/20 | 0.51 |
| ▸ | RAB9A | P51151 | 6/20 | 0.51 |
| ▸ | TP53 | P04637 | 4/20 | 0.51 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.48 |
| ▸ | LMNA | P02545 | 4/20 | 0.48 |
| ▸ | CCR1 | P32246 | 2/20 | 0.48 |
| ▸ | CCR5 | P51681 | 2/20 | 0.48 |
| ▸ | CCR8 | P51685 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | METAP1 | P53582 | 1/20 | 0.48 |
| ▸ | BLM | P54132 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL18078701 | 0.90 | NPC1 (0.49) | SMN1; SMN2NPC1RAB9ATP53CYP2E1 | |
| SCHEMBL13917342 | 0.89 | CYP2C9 (0.53) | SMN1; SMN2NPC1RAB9ACYP2E1CYP3A4 | |
| SCHEMBL19219089 | 0.86 | SMN1; SMN2 (0.54) | SMN1; SMN2NPC1RAB9ATP53CYP2E1 | |
| SCHEMBL10408880 | 0.83 | KDM4E (0.52) | SMN1; SMN2NPC1RAB9ACYP2E1CYP3A4 | |
| SCHEMBL10160337 | 0.82 | KDM4E (0.55) | SMN1; SMN2NPC1RAB9ACYP2E1CYP3A4 | |
| SCHEMBL5067809 | 0.81 | KDM4E (0.56) | SMN1; SMN2NPC1RAB9ATP53CYP2E1 | |
| SCHEMBL30596386 | 0.81 | KDM4E (0.61) | SMN1; SMN2NPC1RAB9ATP53CYP3A4 | |
| SCHEMBL36011 | 0.81 | KDM4E (0.61) | SMN1; SMN2NPC1RAB9ATP53CYP3A4 | |
| SCHEMBL18806862 | 0.81 | KDM4E (0.67) | SMN1; SMN2NPC1RAB9ATP53CYP2A6 | |
| SCHEMBL21636881 | 0.81 | KDM4E (0.67) | SMN1; SMN2NPC1RAB9ATP53CYP2A6 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016143823-A1 | COMPOUND, AND ORGANIC SEMICONDUCTOR MATERIAL CONTAINING SAME | 国立大学法人大阪大学 | 2016-09-15 | — | — | WO | disclosed |