Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17030028 | 0.81 | CYP2C19 (0.43) | TSHRHIF1AALDH1A1ALOX15MAPT | |
| SCHEMBL10647995 | 0.79 | TSHR (0.42) | TSHRALDH1A1 | |
| SCHEMBL9697092 | 0.74 | — | — | |
| SCHEMBL24919988 | 0.73 | CES1 (0.45) | TSHRHIF1AALOX15MEN1CYP1A2 | |
| SCHEMBL5443328 | 0.72 | LMNA (0.54) | TSHRHIF1AALDH1A1ALOX15CYP1A2 | |
| SCHEMBL10413524 | 0.72 | TSHR (0.36) | TSHRALDH1A1SMN1; SMN2 | |
| SCHEMBL17029960 | 0.71 | — | — | |
| Sulfuric Acid SCHEMBL7063446 | 0.70 | ALOX15 (0.46) | TSHRHIF1AALDH1A1ALOX15MEN1 | |
| SCHEMBL17030222 | 0.70 | GMNN (0.44) | TSHRHIF1AALDH1A1ALOX15MAPT | |
| SCHEMBL17030168 | 0.70 | TSHR (0.37) | TSHRHIF1AALDH1A1SMN1; SMN2 |
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-0317131-A1 | Process for purification of N-cyano-N'-methyl-N''-[2-((5-methyl-1H-imidazol-4-yl)methylthio)ethyl]guanidine | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1989-05-24 | — | — | EP | disclosed |