Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | ADH1B | P00325 | 1/20 | 0.34 |
| ▸ | ADH1C | P00326 | 1/20 | 0.34 |
| ▸ | ADH1A | P07327 | 1/20 | 0.34 |
| ▸ | ADH7 | P40394 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | S1PR2 | O95136 | 5/20 | 0.31 |
| ▸ | S1PR4 | O95977 | 5/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.31 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.31 |
| ▸ | SAT1 | P21673 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28708894 | 0.91 | ALDH1A1 (0.35) | TSHRALDH1A1PAOXADH1BADH1A | |
| SCHEMBL728122 | 0.85 | TSHR (0.46) | TSHRALDH1A1CYP2C19KMT2AMEN1 | |
| SCHEMBL29092704 | 0.84 | CA12 (0.43) | TSHRALDH1A1PAOXCYP2C19KMT2A | |
| SCHEMBL3728041 | 0.82 | HTR1B (0.33) | — | |
| SCHEMBL11466946 | 0.81 | TSHR (0.50) | TSHRALDH1A1PAOXCYP2C19KMT2A | |
| SCHEMBL1685473 | 0.80 | TSHR (0.69) | TSHRALDH1A1PAOXCYP2C19KMT2A | |
| SCHEMBL74704 | 0.80 | — | — | |
| SCHEMBL612969 | 0.79 | EPHX1 (0.50) | TSHRALDH1A1ADH1BADH1CADH1A | |
| SCHEMBL28944885 | 0.77 | — | — | |
| SCHEMBL5701157 | 0.77 | TSHR (0.65) | TSHRALDH1A1PAOXCYP2C19KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-8864895-B2 | Aqueous silane systems for bare corrosion protection and corrosion protection of metals | EVONIK DEGUSSA GMBH (DE) | 2014-10-21 | — | — | US | disclosed |
| US-20120204762-A1 | AQUEOUS SILANE SYSTEMS FOR BARE CORROSION PROTECTION AND CORROSION PROTECTION OF METALS | EVONIK DEGUSSA GMBH (DE) | 2012-08-16 | — | — | US | disclosed |