Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | MGAM | O43451 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | SI | P14410 | 1/20 | 0.33 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL280333 | 0.83 | TSHR (0.71) | TSHRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL14433096 | 0.83 | TSHR (0.71) | TSHRALDH1A1MGAMGAASI | |
| SCHEMBL4759428 | 0.82 | TSHR (0.52) | TSHRALDH1A1MGAMGAASI | |
| SCHEMBL28765454 | 0.80 | ALDH1A1 (0.50) | TSHRALDH1A1MGAMGAASI | |
| SCHEMBL7421083 | 0.79 | TSHR (0.64) | TSHRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL614868 | 0.78 | TSHR (0.50) | TSHRALDH1A1PTGS1LMNARECQL | |
| SCHEMBL22310268 | 0.77 | TSHR (0.61) | TSHRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL4304722 | 0.76 | TSHR (0.46) | TSHRALDH1A1MGAMGAASI | |
| SCHEMBL1539265 | 0.75 | ALDH1A1 (0.47) | TSHRALDH1A1PTGS1LMNA | |
| SCHEMBL338444 | 0.75 | ALDH1A1 (0.47) | TSHRALDH1A1PTGS1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3456652-A2 | PROCESS FOR PRODUCING A COATED PACKAGING MATERIAL AND PACKAGING MATERIAL HAVING AT LEAST ONE BARRIER LAYER FOR HYDROPHOBIC COMPOUNDS | Mayr-Melnhof Karton AG (AT) | 2019-03-20 | — | — | EP | disclosed |