Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 9/20 | 0.62 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.39 |
| ▸ | THRB | P10828 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 3/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11244296 | 0.86 | TSHR (0.60) | TSHRHPGDALDH1A1CYP3A4THRB | |
| SCHEMBL12860109 | 0.84 | TSHR (0.61) | TSHRHPGDALDH1A1CYP3A4THRB | |
| SCHEMBL11868203 | 0.83 | TSHR (0.55) | TSHRHPGDALDH1A1CYP3A4THRB | |
| SCHEMBL8191470 | 0.82 | TSHR (0.50) | TSHRHPGDALDH1A1CYP3A4THRB | |
| SCHEMBL1726114 | 0.82 | TSHR (0.44) | TSHRHPGDALDH1A1CYP3A4TP53 | |
| Bromide SCHEMBL3630569 | 0.80 | TSHR (0.56) | TSHRHPGDALDH1A1CYP3A4THRB | |
| SCHEMBL19456761 | 0.80 | TSHR (0.87) | TSHRHPGDALDH1A1CYP3A4THRB | |
| SCHEMBL1480795 | 0.80 | TSHR (0.87) | TSHRHPGDALDH1A1CYP3A4THRB | |
| SCHEMBL8177305 | 0.78 | TSHR (0.46) | TSHRHPGDALDH1A1CYP3A4TP53 | |
| SCHEMBL20359206 | 0.78 | TSHR (0.53) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4323363-A | DISPERSE DYE USED ON POLYESTERS MIXED WITH CELLULOSE | CASSELLA AKTIENGESELLSCHAFT (DE) | 1982-04-06 | — | — | US | disclosed |