Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTB4R | Q15722 | 2/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.37 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.37 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.37 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.37 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.37 |
| ▸ | SENP1 | Q9P0U3 | 2/20 | 0.36 |
| ▸ | SENP2 | Q9HC62 | 1/20 | 0.36 |
| ▸ | TOP2A | P11388 | 1/20 | 0.36 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.36 |
| ▸ | TRPM2 | O94759 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19943040 | 0.87 | LTB4R (0.40) | LTB4REGFRHDAC2BCHEHDAC8 | |
| SCHEMBL23341368 | 0.79 | KDM4E (0.34) | LTB4REGFRHDAC2BCHEHDAC8 | |
| SCHEMBL22293405 | 0.78 | LTB4R (0.36) | LTB4REGFRHDAC2BCHEHDAC8 | |
| SCHEMBL16500966 | 0.77 | RAB9A (0.38) | NPC1RAB9AMEN1MAPTKMT2A | |
| SCHEMBL16500856 | 0.75 | HDAC2 (0.34) | LTB4RHDAC2HDAC8HDAC1HDAC6 | |
| SCHEMBL19529055 | 0.71 | RAB9A (0.33) | NPC1RAB9AMEN1MAPTKMT2A | |
| SCHEMBL17533352 | 0.71 | NPC1 (0.39) | LTB4RHDAC2HDAC8HDAC1NPC1 | |
| SCHEMBL24080769 | 0.69 | RAB9A (0.41) | NPC1RAB9AMEN1MAPTKMT2A | |
| SCHEMBL26499323 | 0.68 | RELA (0.37) | EGFRHDAC2BCHEHDAC8RELA | |
| SCHEMBL28701078 | 0.66 | CYP3A4 (0.56) | BCHERAB9AMEN1MAPTKMT2A |
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-2826079-B1 | ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2021-01-20 | — | — | EP | disclosed |