Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.54 |
| ▸ | THRB | P10828 | 6/20 | 0.51 |
| ▸ | MEN1 | O00255 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | PPARG | P37231 | 4/20 | 0.51 |
| ▸ | THRA | P10827 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | TTR | P02766 | 2/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.51 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.51 |
| ▸ | RXRA | P19793 | 2/20 | 0.51 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | HTR1A | P08908 | 1/20 | 0.51 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL3217395 | 0.86 | THRB (0.73) | CYP2C9HIF1ATHRBMEN1KMT2A | |
| SCHEMBL12200634 | 0.85 | LMNA (0.48) | SIRT5CYP2C9CYP2C19HIF1ATHRB | |
| SCHEMBL12200628 | 0.82 | FOLH1 (0.59) | CYP2C9CYP2C19HIF1ATHRBMEN1 | |
| SCHEMBL11225864 | 0.81 | SIRT5 (0.55) | SIRT5CYP2C9CYP2C19HIF1ATHRB | |
| SCHEMBL9972708 | 0.81 | HMGB1 (0.46) | SIRT5CYP2C9CYP2C19HIF1ATHRB | |
| SCHEMBL5858308 | 0.79 | PTPN1 (0.44) | SIRT5CYP2C9CYP2C19HIF1ATHRB | |
| SCHEMBL14032679 | 0.79 | FFAR4 (0.41) | SIRT5CYP2C9CYP2C19HIF1APTGS2 | |
| Diotyrosine SCHEMBL147578 | 0.79 | SIRT5 (0.82) | SIRT5CYP2C9THRBMEN1KMT2A | |
| Diotyrosine SCHEMBL838215 | 0.79 | SIRT5 (0.82) | SIRT5CYP2C9THRBMEN1KMT2A | |
| Diotyrosine SCHEMBL147579 | 0.79 | SIRT5 (0.82) | SIRT5CYP2C9THRBMEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021216529-A1 | β-ARRESTIN EFFECTORS AND COMPOSITIONS AND METHODS OF USE THEREOF | TREVENA, INC. (US) | 2021-10-28 | — | — | WO | disclosed |