Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 3/20 | 0.38 |
| ▸ | CA2 | P00918 | 3/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA3 | P07451 | 2/20 | 0.38 |
| ▸ | CA4 | P22748 | 2/20 | 0.38 |
| ▸ | CA6 | P23280 | 2/20 | 0.38 |
| ▸ | CA5A | P35218 | 2/20 | 0.38 |
| ▸ | CA7 | P43166 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.38 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.38 |
| ▸ | PSEN1 | P49768 | 3/20 | 0.38 |
| ▸ | PSEN2 | P49810 | 3/20 | 0.38 |
| ▸ | APH1B | Q8WW43 | 3/20 | 0.38 |
| ▸ | NCSTN | Q92542 | 3/20 | 0.38 |
| ▸ | APH1A | Q96BI3 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21032959 | 1.00 | ALDH1A1 (0.41) | ALDH1A1CYP3A4MAPK1CA1CA2 | |
| SCHEMBL21032953 | 0.82 | HTR2A (0.45) | ALDH1A1HTR2AHTR2CKCNH2ELOVL6 | |
| SCHEMBL217625 | 0.76 | ALDH1A1 (0.48) | ALDH1A1CYP3A4MAPK1CA1CA2 | |
| SCHEMBL765653 | 0.74 | ALDH1A1 (0.49) | ALDH1A1CYP3A4MAPK1CA1CA2 | |
| SCHEMBL21032801 | 0.74 | CA1 (0.49) | ALDH1A1CA1CA2CA12CA9 | |
| SCHEMBL2798239 | 0.71 | MAPT (0.50) | ALDH1A1CYP3A4MAPK1CA1CA2 | |
| SCHEMBL4674685 | 0.71 | ALDH1A1 (0.43) | ALDH1A1CYP3A4MAPK1CA1CA2 | |
| Hydrochloric Acid SCHEMBL5271819 | 0.70 | MAPT (0.49) | ALDH1A1CYP3A4MAPK1CA1CA2 | |
| SCHEMBL10794742 | 0.69 | HTR3A (0.47) | ALDH1A1CYP3A4MAPK1CA1CA2 | |
| Hydrochloric Acid SCHEMBL10795400 | 0.68 | HTR3A (0.46) | ALDH1A1CYP3A4MAPK1CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019104201-A1 | SMALL MOLECULE AGONISTS AND ANTAGONISTS OF NR2F6 ACTIVITY IN NON-HUMANS | Zander Therapeutics, Inc. (US) | 2019-05-31 | — | — | WO | disclosed |
| WO-2019104199-A1 | SMALL MOLECULE AGONISTS AND ANTAGONISTS OF NR2F6 ACTIVITY | REGEN BIOPHARMA INC. (US) | 2019-05-31 | — | — | WO | disclosed |