Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.57 |
| ▸ | S1PR2 | O95136 | 6/20 | 0.50 |
| ▸ | S1PR1 | P21453 | 6/20 | 0.50 |
| ▸ | S1PR3 | Q99500 | 6/20 | 0.50 |
| ▸ | S1PR4 | O95977 | 4/20 | 0.50 |
| ▸ | LAP3 | P28838 | 2/20 | 0.46 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.46 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.46 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | GMNN | O75496 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | THPO | P40225 | 1/20 | 0.41 |
| ▸ | MTOR | P42345 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7552156 | 1.00 | TP53 (0.57) | TP53S1PR2S1PR1S1PR3S1PR4 | |
| SCHEMBL27662459 | 1.00 | TP53 (0.57) | TP53S1PR2S1PR1S1PR3S1PR4 | |
| SCHEMBL9657411 | 1.00 | TP53 (0.57) | TP53S1PR2S1PR1S1PR3S1PR4 | |
| SCHEMBL27784488 | 1.00 | TP53 (0.57) | TP53S1PR2S1PR1S1PR3S1PR4 | |
| SCHEMBL28803665 | 0.98 | TP53 (0.59) | TP53S1PR2S1PR1S1PR3S1PR4 | |
| SCHEMBL8076301 | 0.92 | TP53 (0.50) | TP53S1PR2S1PR1S1PR3S1PR4 | |
| SCHEMBL8076303 | 0.92 | TP53 (0.50) | TP53S1PR2S1PR1S1PR3S1PR4 | |
| Sulfuric Acid SCHEMBL28354719 | 0.85 | TP53 (0.69) | TP53S1PR2S1PR1S1PR3S1PR4 | |
| Sulfuric Acid SCHEMBL20515499 | 0.85 | TP53 (0.69) | TP53S1PR2S1PR1S1PR3S1PR4 | |
| Sulfuric Acid SCHEMBL16611550 | 0.85 | TP53 (0.69) | TP53S1PR2S1PR1S1PR3S1PR4 |
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-105431571-A | Organic disulfide based corrosion inhibitors | ECOLAB USA INC | 2016-03-23 | — | — | CN | claimed |
| CN-105431571-A | Organic disulfide based corrosion inhibitors | ECOLAB USA INC | 2016-03-23 | — | — | CN | disclosed |