Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | TBXAS1 | P24557 | 5/20 | 0.50 |
| ▸ | QPCT | Q16769 | 2/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.47 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.47 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.47 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL17961256 | 0.84 | TBXAS1 (0.53) | ALDH1A1SMN1; SMN2TBXAS1CYP19A1 | |
| Ethylbenzene SCHEMBL11148016 | 0.82 | TBXAS1 (0.60) | ALDH1A1SMN1; SMN2KDM4ETBXAS1QPCT | |
| Sulfuric Acid SCHEMBL27681774 | 0.82 | TBXAS1 (0.68) | ALDH1A1TBXAS1QPCT | |
| Sulfuric Acid SCHEMBL4952645 | 0.82 | TBXAS1 (0.68) | ALDH1A1TBXAS1QPCT | |
| Sulfuric Acid SCHEMBL4376046 | 0.82 | TBXAS1 (0.68) | ALDH1A1TBXAS1QPCT | |
| Phenylmethanesulfonic Acid SCHEMBL27713434 | 0.81 | QPCT (0.46) | ALDH1A1SMN1; SMN2TBXAS1QPCTCYP19A1 | |
| SCHEMBL3171416 | 0.80 | TBXAS1 (0.66) | ALDH1A1SMN1; SMN2TBXAS1QPCTCYP19A1 | |
| SCHEMBL14812123 | 0.79 | TBXAS1 (0.60) | ALDH1A1TBXAS1QPCT | |
| SCHEMBL29151655 | 0.79 | TBXAS1 (0.60) | ALDH1A1TBXAS1QPCT | |
| SCHEMBL27713433 | 0.79 | KMT2A (0.49) | ALDH1A1SMN1; SMN2TBXAS1CYP19A1CYP11B1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101189052-B | Fluid storage and purification methods and systems | MATHESON TRI-GAS, INC. (US) | 2012-02-08 | — | — | CN | disclosed |
| CN-101189052-A | Fluid storage and purification methods and systems | MATHESON TRI GAS (US) | 2008-05-28 | — | — | CN | disclosed |