Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.66 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.51 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.47 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | SLC13A5 | Q86YT5 | 1/20 | 0.44 |
| ▸ | NAAA | Q02083 | 1/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | SOX18 | P35713 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | PLAU | P00749 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL21149844 | 0.83 | HDAC1 (0.58) | HDAC1HDAC8FFAR1HDAC3HDAC2 | |
| SCHEMBL30061865 | 0.80 | CYP1A2 (1.00) | CYP1A2CYP2D6CYP2C19HDAC1HDAC8 | |
| SCHEMBL2318140 | 0.80 | CYP1A2 (1.00) | CYP1A2CYP2D6CYP2C19HDAC1HDAC8 | |
| SCHEMBL22201278 | 0.79 | MAPT (0.58) | HDAC1HDAC8FFAR1HDAC3HDAC2 | |
| SCHEMBL22201127 | 0.77 | MAPT (0.61) | HDAC1HDAC8HDAC3HDAC2HDAC6 | |
| SCHEMBL22201233 | 0.77 | TAAR1 (0.46) | HDAC1HDAC8HCAR2FFAR1HDAC3 | |
| SCHEMBL1285452 | 0.77 | CYP1A2 (0.75) | CYP1A2CYP2D6CYP2C19HDAC1HDAC8 | |
| SCHEMBL27862045 | 0.77 | CYP1A2 (0.69) | CYP1A2CYP2D6CYP2C19HDAC1HDAC8 | |
| SCHEMBL21148532 | 0.77 | ALOX5 (0.57) | CYP1A2CYP2D6CYP2C19FFAR1 | |
| SCHEMBL22201167 | 0.76 | HDAC3 (0.47) | HDAC1HDAC8PDPK1FFAR1HDAC3 |
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 |