Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | FAAH | O00519 | 3/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MGLL | Q99685 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.37 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.37 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.37 |
| ▸ | GMNN | O75496 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22201158 | 1.00 | ALDH1A1 (0.46) | ALDH1A1L3MBTL1FAAHTRPV1TSHR | |
| SCHEMBL5475404 | 0.91 | ALDH1A1 (0.39) | ALDH1A1L3MBTL1FAAHTRPV1TSHR | |
| SCHEMBL5175881 | 0.91 | ALDH1A1 (0.53) | ALDH1A1L3MBTL1CYP1A2S1PR2S1PR4 | |
| SCHEMBL22190342 | 0.91 | ALDH1A1 (0.53) | ALDH1A1L3MBTL1CYP1A2S1PR2S1PR4 | |
| SCHEMBL5872353 | 0.91 | ALDH1A1 (0.53) | ALDH1A1L3MBTL1CYP1A2S1PR2S1PR4 | |
| SCHEMBL9646435 | 0.91 | ALDH1A1 (0.53) | ALDH1A1L3MBTL1CYP1A2S1PR2S1PR4 | |
| SCHEMBL22201153 | 0.91 | ALDH1A1 (0.53) | ALDH1A1L3MBTL1CYP1A2S1PR2S1PR4 | |
| SCHEMBL8051534 | 0.91 | ALDH1A1 (0.53) | ALDH1A1L3MBTL1CYP1A2S1PR2S1PR4 | |
| SCHEMBL3503763 | 0.89 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1CYP1A2S1PR2S1PR4 | |
| Hydrochloric Acid SCHEMBL5493851 | 0.89 | ALDH1A1 (0.38) | ALDH1A1L3MBTL1FAAHTRPV1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020141734-A1 | METHOD FOR PREPARING CHIRAL GAMMA-LACTAM COMPOUND AND METAL COMPLEX THEREFOR | 기초과학연구원 | 2020-07-09 | — | — | WO | disclosed |