Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.49 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.44 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | XBP1 | P17861 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10006060 | 0.85 | CYP17A1 (0.46) | KIF11RAB9ANPC1SMN1; SMN2MEN1 | |
| SCHEMBL10298926 | 0.81 | TSHR (0.50) | RAB9ANPC1MAPTSLC6A2PTGS1 | |
| SCHEMBL2090691 | 0.79 | NR1H4 (0.65) | KIF11EPHX2NR1H4RAB9ANPC1 | |
| SCHEMBL10281198 | 0.75 | PTGS1 (0.48) | RAB9ANPC1SMN1; SMN2MEN1MAPT | |
| SCHEMBL3828984 | 0.73 | PTGS2 (0.71) | PTGS1PTGS2 | |
| SCHEMBL9730038 | 0.73 | SLC6A2 (0.42) | KIF11RAB9ANPC1SLC6A2PTGS1 | |
| SCHEMBL13651401 | 0.69 | EPHX2 (0.50) | KIF11EPHX2NR1H4RAB9ANPC1 | |
| SCHEMBL28911724 | 0.69 | EPHX2 (0.50) | KIF11EPHX2NR1H4RAB9ANPC1 | |
| SCHEMBL9941076 | 0.68 | KIF11 (0.37) | KIF11RAB9ANPC1SLC6A2PTGS1 | |
| SCHEMBL9939438 | 0.68 | PTGER2 (0.47) | KIF11EPHX2NR1H4RAB9ANPC1 |
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-2651885-A1 | ANTI-VIRAL COMPOUNDS | Abbvie Inc. (US) | 2013-10-23 | — | — | EP | disclosed |
| WO-2012083170-A1 | ANTI-VIRAL COMPOUNDS | ABBOTT LABORATORIES (US) | 2012-06-21 | — | — | WO | disclosed |