Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2939730 | 0.89 | THRB (0.44) | ALDH1A1THRBTSHR | |
| Hydrochloric Acid SCHEMBL1237638 | 0.87 | THRB (0.43) | ALDH1A1THRBTSHR | |
| SCHEMBL547837 | 0.84 | ALDH1A1 (0.39) | ALDH1A1THRBTSHR | |
| Hydrochloric Acid SCHEMBL8004364 | 0.77 | ALDH1A1 (0.41) | ALDH1A1THRBTSHR | |
| Sulfuric Acid SCHEMBL8720200 | 0.76 | TSHR (0.40) | ALDH1A1THRBTSHR | |
| Trimethylammonium SCHEMBL361090 | 0.76 | THRB (0.46) | ALDH1A1THRBTSHR | |
| SCHEMBL8426138 | 0.75 | THRB (0.37) | ALDH1A1THRBTSHR | |
| SCHEMBL27621480 | 0.74 | THRB (0.41) | ALDH1A1THRBTSHR | |
| SCHEMBL3675723 | 0.74 | THRB (0.43) | ALDH1A1THRBTSHR | |
| SCHEMBL11139404 | 0.74 | TSHR (0.55) | ALDH1A1THRBTSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-7892340-B2 | Ink-jet recording ink, ink-jet recording ink set, ink-jet recording ink media set, ink cartridge, ink-jet recording method and ink-jet recording apparatus | RICOH COMPANY, LTD. (JP) | 2011-02-22 | — | — | US | disclosed |
| US-20100227067-A1 | INK-JET RECORDING INK, INK-JET RECORDING INK SET, INK-JET RECORDING INK MEDIA SET, INK CARTRIDGE, INK-JET RECORDING METHOD AND INK-JET RECORDING APPARATUS | RICOH COMPANY, LTD. (JP) | 2010-09-09 | — | — | US | disclosed |