Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.42 |
| ▸ | KCNK9 | Q9NPC2 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14344773 | 0.83 | PARP1 (0.52) | PARP1HDAC8HDAC6ACHESMN1; SMN2 | |
| SCHEMBL1793374 | 0.78 | PARP1 (0.56) | PARP1HDAC8HDAC6ACHESMN1; SMN2 | |
| SCHEMBL1536312 | 0.78 | PARP1 (0.57) | PARP1HDAC8HDAC6SMN1; SMN2HPGD | |
| SCHEMBL30384789 | 0.76 | PARP1 (0.66) | PARP1HDAC8HDAC6SMN1; SMN2HPGD | |
| SCHEMBL1383743 | 0.76 | PARP1 (0.66) | PARP1HDAC8HDAC6SMN1; SMN2HPGD | |
| SCHEMBL610252 | 0.76 | PARP1 (0.54) | PARP1HDAC8HDAC6ACHESMN1; SMN2 | |
| SCHEMBL3759037 | 0.76 | PARP1 (0.54) | PARP1HDAC8HDAC6ACHESMN1; SMN2 | |
| SCHEMBL8334527 | 0.76 | PARP1 (0.54) | PARP1HDAC8HDAC6ACHESMN1; SMN2 | |
| SCHEMBL29444189 | 0.76 | PARP1 (0.54) | PARP1HDAC8HDAC6ACHESMN1; SMN2 | |
| SCHEMBL1411275 | 0.74 | PARP1 (0.63) | PARP1HDAC8HDAC6ACHESMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2588527-B1 | HOLE TRANSPORT COMPOSITIONS AND RELATED DEVICES AND METHODS (I) | NISSAN CHEMICAL IND LTD (JP) | 2017-10-25 | — | — | EP | disclosed |