Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 1/20 | 0.35 |
| ▸ | LDHB | P07195 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL10822012 | 1.00 | LDHA (0.35) | LDHALDHBALDH1A1TP53TSHR | |
| SCHEMBL7562119 | 0.72 | LDHA (0.35) | LDHALDHBACHE | |
| SCHEMBL7562115 | 0.72 | LDHA (0.35) | LDHALDHBACHE | |
| SCHEMBL2418090 | 0.67 | PTGS1 (0.34) | ALDH1A1TP53TSHR | |
| SCHEMBL2418084 | 0.67 | PTGS1 (0.34) | ALDH1A1TP53TSHR | |
| Carbon Tetrachloride SCHEMBL11449812 | 0.64 | — | — | |
| SCHEMBL7872806 | 0.63 | OR51E2 (0.33) | ALDH1A1TP53TSHR | |
| SCHEMBL7872808 | 0.63 | OR51E2 (0.33) | ALDH1A1TP53TSHR | |
| SCHEMBL1223513 | 0.63 | — | — | |
| Urea SCHEMBL1258728 | 0.63 | ALDH1A1 (0.43) | ALDH1A1TP53TSHRACHE |
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 |
|---|---|---|---|---|---|---|---|
| US-4586948-A | 2,4-disubstituted-5-thiazole-carboxylic acids and derivatives | MONSANTO COMPANY (US) | 1986-05-06 | — | — | US | disclosed |