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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 7/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 2/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19971271 | 0.83 | BBOX1 (0.42) | TSHRHPGDALDH1A1CYP3A4THRB | |
| SCHEMBL19971232 | 0.82 | TSHR (0.45) | TSHRHPGDALDH1A1CYP3A4THRB | |
| SCHEMBL6401478 | 0.80 | TSHR (0.45) | TSHRHPGDALDH1A1CYP3A4THRB | |
| SCHEMBL27569036 | 0.79 | TSHR (0.40) | TSHRHPGDALDH1A1CYP3A4THRB | |
| SCHEMBL27834736 | 0.79 | TSHR (0.39) | TSHRHPGDALDH1A1CYP3A4THRB | |
| SCHEMBL11759187 | 0.77 | TSHR (0.38) | TSHRHPGDALDH1A1CYP3A4THRB | |
| SCHEMBL11318596 | 0.77 | SLC22A1 (0.44) | TSHRHPGDALDH1A1CYP3A4TP53 | |
| SCHEMBL19971312 | 0.77 | TSHR (0.41) | TSHRHPGDALDH1A1CYP3A4THRB | |
| SCHEMBL11762905 | 0.76 | TSHR (0.39) | TSHRHPGDALDH1A1CYP3A4THRB | |
| SCHEMBL16673381 | 0.75 | TSHR (0.50) | TSHRHPGDALDH1A1CYP3A4THRB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4158595-A | AQUEOUS SUSPENSION OF ANIONIC AND CATIONIC NITROGEN-CONTAINING POLYMERS | HERCULES INCORPORATED (US) | 1979-06-19 | — | — | US | disclosed |
| US-4154647-A | TREATMENT WITH AQUEOUS MIXTURE OF CATIONIC AND ANIONIC WATER-SOLUBLE NITROGEN-CONTAINING POLYMERS | HERCULES INCORPORATED (US) | 1979-05-15 | — | — | US | disclosed |
| EP-0000628-A1 | Process of preparing hydrophilic polyolefin fibers, the fibers so produced, and paper containing said fibers. | HERCULES INCORPORATED (US) | 1979-02-07 | — | — | EP | disclosed |