Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 2/20 | 0.33 |
| ▸ | CES1 | P23141 | 2/20 | 0.33 |
| ▸ | CCR1 | P32246 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7327175 | 1.00 | ALDH1A1 (0.36) | ALDH1A1SLC6A4SLC6A3BRD4P2RX7 | |
| SCHEMBL8391216 | 0.85 | DRD2 (0.38) | ALDH1A1SLC6A4SLC6A3P2RX7HPGD | |
| SCHEMBL7327187 | 0.85 | DRD2 (0.38) | ALDH1A1SLC6A4SLC6A3P2RX7HPGD | |
| SCHEMBL7325713 | 0.76 | DRD3 (0.38) | ALDH1A1P2RX7HPGDCES2CES1 | |
| SCHEMBL4674963 | 0.71 | CES2 (0.42) | ALDH1A1HPGDCES2CES1MEN1 | |
| SCHEMBL16235300 | 0.69 | TRPA1 (0.47) | ALDH1A1CES2CES1MEN1KMT2A | |
| SCHEMBL16235100 | 0.69 | TRPA1 (0.47) | ALDH1A1CES2CES1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL16234863 | 0.68 | TRPA1 (0.46) | ALDH1A1CES2CES1MEN1KMT2A | |
| SCHEMBL7327084 | 0.66 | MAPT (0.38) | ALDH1A1P2RX7HPGDMAPTCYP2C19 | |
| SCHEMBL28626237 | 0.66 | TSHR (0.50) | ALDH1A1HPGDCES2CES1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-6376506-B1 | REACTING SULFAMOYL OXAZOLIDONE WITH (1,2,3,4)-TETRAHYDRO-BETA-CARBOLINE TO FORM INHIBITOR; USED TO TREAT ARTHRITIS, OSTEOPOROSIS, PERIODONTAL DISEASE, CARDIOVASCULAR DISEASES, MULTIPLE SCLEROSIS, AND TUMORS | SYNTEX (U.S.A.) LLC | 2002-04-23 | — | — | US | disclosed |
| US-6130220-A | ENZYME INHIBITORS | SYNTEX (USA) INC. (US) | 2000-10-10 | — | — | US | disclosed |