Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | TSHR | P16473 | 4/20 | 0.47 |
| ▸ | TP53 | P04637 | 3/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 3/20 | 0.39 |
| ▸ | THRA | P10827 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 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 | |
|---|---|---|---|---|
| SCHEMBL5704079 | 0.89 | ALDH1A1 (0.47) | ALDH1A1TSHRTP53HIF1ACYP3A4 | |
| SCHEMBL29719280 | 0.89 | ALDH1A1 (0.47) | ALDH1A1TSHRTP53HIF1ACYP3A4 | |
| SCHEMBL29719415 | 0.89 | ALDH1A1 (0.47) | ALDH1A1TSHRTP53HIF1ACYP3A4 | |
| SCHEMBL1262594 | 0.85 | ALDH1A1 (0.46) | ALDH1A1TSHRTP53HIF1ACYP3A4 | |
| Methane SCHEMBL6577549 | 0.84 | ALDH1A1 (0.45) | ALDH1A1TSHRTP53HIF1ACYP3A4 | |
| SCHEMBL18297876 | 0.82 | ALDH1A1 (0.46) | ALDH1A1TSHRTP53HIF1ACYP3A4 | |
| SCHEMBL7760750 | 0.81 | ALDH1A1 (0.46) | ALDH1A1TSHRTP53HIF1ACYP3A4 | |
| SCHEMBL6295940 | 0.81 | ALDH1A1 (0.55) | ALDH1A1TSHRTP53HIF1ACYP3A4 | |
| SCHEMBL5704044 | 0.81 | ALDH1A1 (0.47) | ALDH1A1TSHRTP53HIF1ACYP3A4 | |
| SCHEMBL1104781 | 0.81 | ALDH1A1 (0.55) | ALDH1A1TSHRTP53HIF1ACYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1057808-B1 | Sulfur-containing unsaturated carboxylate compound and its use | MITSUI CHEMICALS INC (JP) | 2007-03-14 | — | — | EP | disclosed |
| US-6458908-B1 | A PROCESS FOR PREPARING A SULFUR-CONTAINING UNSATURATED CARBOXYLATE COMPOUND AS CLAIMED IN CLAIM 1 COMPRISING REACTING A SULFUR-CONTAINING DERIVATIVE FOR OPTICAL POLYMERS | MITSUI CHEMICALS, INC. (JP) | 2002-10-01 | — | — | US | disclosed |
| EP-1057808-A2 | Sulfur-containing unsaturated carboxylate compound and its use | Mitsui Chemicals, Inc. (JP) | 2000-12-06 | — | — | EP | disclosed |