Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | ACLY | P53396 | 4/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 2/20 | 0.41 |
| ▸ | GSK3A | P49840 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | ME2 | P23368 | 1/20 | 0.40 |
| ▸ | ME1 | P48163 | 1/20 | 0.40 |
| ▸ | ME3 | Q16798 | 1/20 | 0.40 |
| ▸ | CDK4 | P11802 | 2/20 | 0.39 |
| ▸ | CCND1 | P24385 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | GRK6 | P43250 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10783294 | 0.92 | HDAC4 (0.53) | HDAC4HDAC2HDAC8ACLYBACE1 | |
| SCHEMBL10942758 | 0.92 | HDAC4 (0.53) | HDAC4HDAC2HDAC8ACLYBACE1 | |
| SCHEMBL10936310 | 0.87 | ACLY (0.44) | HDAC4HDAC2HDAC8ACLYBACE1 | |
| SCHEMBL10937987 | 0.86 | FFAR1 (0.42) | HSP90AA1GAATP53MAPTTSHR | |
| SCHEMBL9649124 | 0.85 | CSNK2A2 (0.51) | HDAC4HDAC2HDAC8ACLYBACE1 | |
| SCHEMBL10934864 | 0.85 | HDAC4 (0.46) | HDAC4HDAC2HDAC8ACLYBACE1 | |
| SCHEMBL10938705 | 0.85 | GSK3B (0.46) | HDAC4HDAC2HDAC8ACLYBACE1 | |
| SCHEMBL10936274 | 0.85 | HDAC4 (0.46) | HDAC4HDAC2HDAC8ACLYBACE1 | |
| SCHEMBL10936408 | 0.84 | MAOB (0.42) | BACE1GAANPC1MAPTTSHR | |
| SCHEMBL10937102 | 0.84 | GPR84 (0.42) | GAANPC1MAPTTSHRRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-4532069-A | For electro-optical display elements | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1985-07-30 | — | — | US | claimed |
| US-4532069-A | For electro-optical display elements | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1985-07-30 | — | — | US | disclosed |