Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 8/20 | 0.54 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.49 |
| ▸ | CXCR3 | P49682 | 6/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28769816 | 1.00 | ACE (0.54) | ACEABCB11CXCR3HDAC8POLB | |
| SCHEMBL27705634 | 0.92 | ACE (0.52) | ACEABCB11CXCR3HDAC8 | |
| SCHEMBL27705638 | 0.92 | ACE (0.52) | ACEABCB11CXCR3HDAC8 | |
| SCHEMBL27705695 | 0.91 | ACE (0.55) | ACEABCB11CXCR3HDAC8POLB | |
| SCHEMBL27705696 | 0.91 | ACE (0.55) | ACEABCB11CXCR3HDAC8POLB | |
| SCHEMBL27726211 | 0.89 | HDAC8 (0.57) | ACEABCB11CXCR3HDAC8 | |
| SCHEMBL22962224 | 0.89 | HDAC8 (0.57) | ACEABCB11CXCR3HDAC8 | |
| SCHEMBL27726210 | 0.89 | HDAC8 (0.57) | ACEABCB11CXCR3HDAC8 | |
| SCHEMBL27726222 | 0.89 | ACE (0.55) | ACEABCB11CXCR3HDAC8 | |
| SCHEMBL27726225 | 0.89 | ACE (0.55) | ACEABCB11CXCR3HDAC8 |
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 |