Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 1/20 | 0.47 |
| ▸ | CTSK | P43235 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | BACE1 | P56817 | 3/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | NQO2 | P16083 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11573224 | 0.89 | CTSK (0.46) | CTSSCTSKHDAC4HDAC1BACE1 | |
| SCHEMBL23611110 | 0.87 | CTSK (0.49) | CTSSCTSKHDAC4HDAC1BACE1 | |
| SCHEMBL23611112 | 0.87 | CTSK (0.49) | CTSSCTSKHDAC4HDAC1BACE1 | |
| SCHEMBL11880230 | 0.87 | L3MBTL1 (0.48) | CTSSCTSKHDAC4HDAC1BACE1 | |
| SCHEMBL11573817 | 0.87 | CTSS (0.47) | CTSSCTSKHDAC4HDAC1BACE1 | |
| SCHEMBL3379447 | 0.84 | CTSS (0.48) | CTSSCTSKALDH1A1HSD17B10L3MBTL1 | |
| SCHEMBL3379450 | 0.84 | CTSS (0.48) | CTSSCTSKALDH1A1HSD17B10L3MBTL1 | |
| SCHEMBL11875007 | 0.84 | CTSK (0.49) | CTSSCTSKHDAC4HDAC1BACE1 | |
| SCHEMBL8867310 | 0.84 | CTSS (0.46) | CTSSCTSKHDAC4HDAC1ALDH1A1 | |
| SCHEMBL8867317 | 0.84 | CTSS (0.46) | CTSSCTSKHDAC4HDAC1ALDH1A1 |
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-3988451-A | ANTIBACTERIAL | SMITHKLINE CORPORATION (US) | 1976-10-26 | — | — | US | disclosed |
| US-3931160-A | BACTERICIDE | SMITHKLINE CORPORATION (US) | 1976-01-06 | — | — | US | disclosed |