Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.56 |
| ▸ | ACE | P12821 | 6/20 | 0.51 |
| ▸ | CTSS | P25774 | 1/20 | 0.51 |
| ▸ | CTSK | P43235 | 1/20 | 0.51 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.50 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.48 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.47 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL27726227 | 1.00 | HDAC8 (0.56) | HDAC8ACECTSSCTSKOPRD1 | |
| SCHEMBL22962224 | 0.94 | HDAC8 (0.57) | HDAC8ACECTSSCTSKABCB11 | |
| SCHEMBL27726211 | 0.94 | HDAC8 (0.57) | HDAC8ACECTSSCTSKABCB11 | |
| SCHEMBL27726210 | 0.94 | HDAC8 (0.57) | HDAC8ACECTSSCTSKABCB11 | |
| SCHEMBL27705637 | 0.87 | HDAC8 (0.58) | HDAC8ACECTSSCTSKDPP8 | |
| SCHEMBL22962231 | 0.87 | HDAC8 (0.58) | HDAC8ACECTSSCTSKDPP8 | |
| SCHEMBL27705687 | 0.87 | HDAC8 (0.58) | HDAC8ACECTSSCTSKDPP8 | |
| SCHEMBL27705696 | 0.86 | ACE (0.55) | HDAC8ACEABCB11 | |
| SCHEMBL27705695 | 0.86 | ACE (0.55) | HDAC8ACEABCB11 | |
| SCHEMBL28769818 | 0.85 | ACE (0.54) | HDAC8ACEABCB11 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101200493-B | (3S)-N-(L-aminoacyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid, preparation method and uses thereof | UNIV CAPITAL MEDICAL | 2011-11-09 | — | — | CN | disclosed |
| CN-101200493-A | (3S)-N-(L-aminoacyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid, preparation method and uses thereof | UNIV CAPITAL MEDICAL SCIENCES (CN) | 2008-06-18 | — | — | CN | disclosed |