Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | BHMT | Q93088 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.39 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.37 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.37 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL1104269 | 0.94 | BHMT (0.47) | TSHRBHMTLMNAKMT2AHSD17B10 | |
| SCHEMBL1104282 | 0.92 | BHMT (0.49) | TSHRBHMTLMNATDP1SLC22A6 | |
| SCHEMBL1104232 | 0.88 | LMNA (0.54) | TSHRBHMTLMNAKMT2AHSD17B10 | |
| Stearic Acid SCHEMBL28585846 | 0.85 | FFAR4 (0.56) | TSHRKMT2AHSD17B10TDP1SLC22A6 | |
| SCHEMBL23344441 | 0.80 | LMNA (0.42) | LMNAALDH1A1 | |
| SCHEMBL6310446 | 0.80 | LMNA (0.42) | LMNAALDH1A1 | |
| SCHEMBL6302289 | 0.78 | LMNA (0.40) | LMNAALDH1A1 | |
| SCHEMBL21676202 | 0.78 | LMNA (0.40) | LMNAALDH1A1 | |
| SCHEMBL15430561 | 0.78 | PLA2G4B (0.46) | TSHRBHMTLMNAKMT2APLA2G4B | |
| Glutarate SCHEMBL22490703 | 0.75 | SLC22A6 (0.61) | TSHRLMNAKMT2ACAMK2ASLC22A6 |
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-0638588-A1 | Derivatives of 6,7-Dihydroxy-4-thiaheptonic acid and their use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1995-02-15 | — | — | EP | disclosed |