Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 3/20 | 0.39 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.38 |
| ▸ | DCLRE1B | Q9H816 | 3/20 | 0.38 |
| ▸ | DCLRE1A | Q6PJP8 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.33 |
| ▸ | ACE2 | Q9BYF1 | 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 | |
|---|---|---|---|---|
| SCHEMBL1073276 | 0.81 | KDM4E (0.47) | PTPN1FOLH1DCLRE1BDCLRE1ACYP1A2 | |
| SCHEMBL926234 | 0.79 | CA12 (0.53) | PTPN1FOLH1ACMSDALDH1A1TSHR | |
| SCHEMBL29140046 | 0.78 | CSNK2A1 (0.48) | PTPN1FOLH1ALDH1A1CA12CA1 | |
| SCHEMBL26866 | 0.78 | KEAP1 (0.47) | PTPN1FOLH1DCLRE1BDCLRE1ACYP1A2 | |
| SCHEMBL7100581 | 0.78 | ALDH1A1 (0.53) | PTPN1FOLH1DCLRE1BDCLRE1ACYP1A2 | |
| SCHEMBL17008903 | 0.78 | KDM4E (0.47) | PTPN1FOLH1DCLRE1BDCLRE1AKDM4E | |
| SCHEMBL28426592 | 0.78 | SMN1; SMN2 (0.55) | DCLRE1BALDH1A1TSHRCA1CA2 | |
| SCHEMBL29151337 | 0.78 | PTPN1 (0.42) | PTPN1FOLH1CYP1A2ACMSDALDH1A1 | |
| Hydrochloric Acid SCHEMBL29118312 | 0.76 | KEAP1 (0.46) | PTPN1FOLH1DCLRE1BDCLRE1ACYP1A2 | |
| Acetic Acid SCHEMBL28798460 | 0.75 | ALDH1A1 (0.48) | PTPN1ACMSDALDH1A1TSHRCA12 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2801570-A1 | Inhibitors of beta-secretase | Vitae Pharmaceuticals, Inc. (US) | 2014-11-12 | — | — | EP | disclosed |