Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 8/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | THRB | P10828 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | DGKA | P23743 | 1/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.40 |
| ▸ | RARB | P10826 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL50459 | 0.86 | — | — | |
| SCHEMBL12506464 | 0.83 | ALDH1A1 (0.41) | TSHRALDH1A1HPGDTHRBATM | |
| SCHEMBL9462492 | 0.82 | TSHR (0.52) | TSHRCYP3A4ALDH1A1HPGDTHRB | |
| SCHEMBL9350594 | 0.82 | TSHR (0.52) | TSHRCYP3A4ALDH1A1HPGDTHRB | |
| SCHEMBL28365041 | 0.82 | TSHR (0.52) | TSHRCYP3A4ALDH1A1HPGDTHRB | |
| SCHEMBL11517487 | 0.82 | TSHR (0.52) | TSHRCYP3A4ALDH1A1HPGDTHRB | |
| SCHEMBL302306 | 0.82 | TSHR (0.52) | TSHRCYP3A4ALDH1A1HPGDTHRB | |
| SCHEMBL11145409 | 0.80 | TSHR (0.50) | TSHRCYP3A4ALDH1A1HPGDTHRB | |
| SCHEMBL5483768 | 0.80 | TSHR (0.50) | TSHRCYP3A4ALDH1A1HPGDTHRB | |
| SCHEMBL5933186 | 0.80 | TSHR (0.50) | TSHRCYP3A4ALDH1A1HPGDTHRB |
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-5670563-A | ORGANOTIN COMPOUND, PHOSPHORUS COMPOUND | CIBA-SPECIALTY CHEMICALS CORPORATION (US) | 1997-09-23 | — | — | US | disclosed |