Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HMGCR | P04035 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | CPT2 | P23786 | 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 |
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 | |
|---|---|---|---|---|
| SCHEMBL2829358 | 0.92 | DGAT1 (0.41) | HMGCRCHRM1TBXA2RADRA1ADGAT1 | |
| SCHEMBL18196451 | 0.92 | ALDH1A1 (0.48) | ALDH1A1HMGCRCHRM1TBXA2RADRA1A | |
| SCHEMBL2829360 | 0.86 | ALDH1A1 (0.60) | ALDH1A1HMGCRCHRM1TBXA2RADRA1A | |
| SCHEMBL20377364 | 0.86 | ALDH1A1 (0.36) | ALDH1A1HMGCRCHRM1TBXA2RADRA1A | |
| SCHEMBL2957588 | 0.86 | ALDH1A1 (0.36) | ALDH1A1HMGCRCHRM1TBXA2RADRA1A | |
| SCHEMBL28483044 | 0.80 | DGAT1 (0.48) | HMGCRCHRM1TBXA2RADRA1ADGAT1 | |
| SCHEMBL9249667 | 0.79 | ALDH1A1 (0.48) | ALDH1A1HMGCRCHRM1TBXA2RADRA1A | |
| SCHEMBL8129588 | 0.78 | HMGCR (0.38) | HMGCRCHRM1TBXA2RADRA1ADGAT1 | |
| SCHEMBL20845363 | 0.78 | HMGCR (0.65) | ALDH1A1HMGCRCHRM1TBXA2RADRA1A | |
| SCHEMBL28483049 | 0.77 | DGAT1 (0.45) | DGAT1CYP2D6TSHRTDP1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| 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-5391771-A | Reacting citric acid or esters on hydrogenation catalyst in nonaqueous solvent | BASF AKTIENGESELLSCHAFT | 1995-02-21 | — | — | US | disclosed |