Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 1/20 | 0.46 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.44 |
| ▸ | DPP4 | P27487 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 6/20 | 0.41 |
| ▸ | USP2 | O75604 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL15559068 | 0.87 | ADRB1 (0.49) | ADRB1NR2E1DPP4ALDH1A1FFAR4 | |
| SCHEMBL20040866 | 0.86 | ADRB1 (0.47) | ADRB1NR2E1DPP4ALDH1A1FFAR4 | |
| SCHEMBL16904561 | 0.84 | ADRB1 (0.46) | ADRB1NR2E1DPP4ALDH1A1FFAR4 | |
| SCHEMBL1603395 | 0.82 | ADRB1 (0.53) | ADRB1NR2E1DPP4ALDH1A1HTT | |
| SCHEMBL23113436 | 0.82 | ADRB1 (0.53) | ADRB1NR2E1DPP4ALDH1A1HTT | |
| SCHEMBL20568416 | 0.81 | DPP4 (0.47) | ADRB1NR2E1DPP4ALDH1A1FFAR4 | |
| SCHEMBL20568415 | 0.81 | DPP4 (0.47) | ADRB1NR2E1DPP4ALDH1A1FFAR4 | |
| SCHEMBL273503 | 0.81 | ADRA2C (0.53) | ADRB1NR2E1ALDH1A1HTTGAA | |
| SCHEMBL1420198 | 0.81 | L3MBTL3 (0.50) | ADRB1NR2E1DPP4ALDH1A1FFAR4 | |
| SCHEMBL20040842 | 0.80 | DPP4 (0.44) | ADRB1NR2E1DPP4FFAR4MEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1165531-C | Alpha-methylbenzyl-containing thiourea inhibitors of herpes viruses containing phenylenediamine groups | — | 2004-09-08 | — | — | CN | disclosed |
| CN-1333750-A | Acetamide and substituted acetamide-containing thiourea inhibitors of herpes viruses | AMERICAN HOME PROD (US) | 2002-01-30 | — | — | CN | disclosed |
| CN-1332725-A | Thiourea inhibitors of herpes viruses | AMERICAN HOME PROD (US) | 2002-01-23 | — | — | CN | disclosed |
| CN-1329608-A | Alpha-methylbenzyl-containing thioure a inhibitors of herpes viruses containing phenylenediamine group | AMERICAN HOME PROD (US) | 2002-01-02 | — | — | CN | disclosed |