Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | HMGCR | P04035 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.34 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | SLC13A5 | Q86YT5 | 2/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2829360 | 0.94 | ALDH1A1 (0.60) | ALDH1A1TSHRHMGCRCHRM1TBXA2R | |
| SCHEMBL17243716 | 0.92 | ALDH1A1 (0.41) | ALDH1A1TSHRHMGCRCHRM1TBXA2R | |
| SCHEMBL2957592 | 0.89 | ALDH1A1 (0.39) | ALDH1A1TSHRHMGCRCHRM1TBXA2R | |
| SCHEMBL2829358 | 0.82 | DGAT1 (0.41) | HMGCRCHRM1TBXA2RADRA1ACYP2D6 | |
| SCHEMBL9249653 | 0.79 | ALDH1A1 (0.41) | ALDH1A1TSHRHMGCRCHRM1TBXA2R | |
| SCHEMBL31675017 | 0.79 | ALDH1A1 (0.52) | ALDH1A1TSHRHMGCRCHRM1TBXA2R | |
| SCHEMBL4831111 | 0.79 | CYP2D6 (0.37) | ALDH1A1TSHRHMGCRCHRM1TBXA2R | |
| SCHEMBL6761013 | 0.79 | CYP2D6 (0.37) | ALDH1A1TSHRHMGCRCHRM1TBXA2R | |
| SCHEMBL27568297 | 0.78 | TSHR (0.35) | ALDH1A1TSHRHMGCRCHRM1TBXA2R | |
| SCHEMBL10939959 | 0.78 | HMGCR (0.48) | ALDH1A1TSHRHMGCRCHRM1TBXA2R |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018065475-A1 | METHOD FOR THE PRODUCTION OF METHYLSUCCINIC ACID AND THE ANHYDRIDE THEREOF FROM CITRIC ACID | KATHOLIEKE UNIVERSITEIT LEUVEN (BE) | 2018-04-12 | — | — | WO | disclosed |
| US-20110124765-A1 | Versatile Biodegradable Elastic Polymers Featured with Dual Crosslinking Mechanism for Biomedical Applications | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2011-05-26 | — | — | US | disclosed |
| US-5391771-A | Reacting citric acid or esters on hydrogenation catalyst in nonaqueous solvent | BASF AKTIENGESELLSCHAFT | 1995-02-21 | — | — | US | disclosed |