Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 3/20 | 0.37 |
| ▸ | CA6 | P23280 | 3/20 | 0.37 |
| ▸ | CA7 | P43166 | 3/20 | 0.37 |
| ▸ | CA9 | Q16790 | 3/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.37 |
| ▸ | CA5B | Q9Y2D0 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA3 | P07451 | 2/20 | 0.37 |
| ▸ | CA4 | P22748 | 2/20 | 0.37 |
| ▸ | CA5A | P35218 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL15658337 | 0.87 | CYP2C9 (0.39) | ACE2CYP2C9CYP2C19CA12CA6 | |
| Trientine SCHEMBL9064125 | 0.87 | CYP2C9 (0.39) | ACE2CYP2C9CYP2C19CA12CA6 | |
| SCHEMBL16912671 | 0.85 | CYP2C9 (0.40) | ACE2CYP2C9CYP2C19CA12CA6 | |
| SCHEMBL28385533 | 0.84 | — | — | |
| SCHEMBL9064220 | 0.79 | CYP2C9 (0.32) | ACE2CYP2C9CYP2C19TDP1 | |
| SCHEMBL2478832 | 0.77 | CYP2C9 (0.31) | ACE2CYP2C9CYP2C19 | |
| SCHEMBL8977957 | 0.75 | CYP2C9 (0.37) | ACE2CYP2C9CYP2C19CA12CA6 | |
| SCHEMBL8977990 | 0.73 | CYP2C9 (0.38) | ACE2CYP2C9CYP2C19CA12CA6 | |
| SCHEMBL1264193 | 0.73 | — | — | |
| SCHEMBL2478304 | 0.72 | ACE2 (0.47) | ACE2CYP2C9CYP2C19CA12CA6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3283668-A1 | THIN CORROSION PROTECTIVE COATINGS INCORPORATING POLYAMIDOAMINE POLYMERS | Henkel AG & Co. KGaA (DE) | 2018-02-21 | — | — | EP | disclosed |
| WO-2016167928-A1 | THIN CORROSION PROTECTIVE COATINGS INCORPORATING POLYAMIDOAMINE POLYMERS | HENKEL AG & CO. KGAA (DE) | 2016-10-20 | — | — | WO | disclosed |