Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | PSD | A5PKW4 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | TDO2 | P48775 | 1/20 | 0.39 |
| ▸ | KDM4A | O75164 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2649769 | 0.89 | DHODH (0.44) | MAPTDHODHNPSR1 | |
| SCHEMBL2649657 | 0.88 | GAA (0.44) | POLBMAPTPTGS1PTGS2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL2662079 | 0.87 | GAA (0.43) | POLBMAPTPTGS1PTGS2ALDH1A1 | |
| SCHEMBL2648330 | 0.85 | PTGS2 (0.45) | MAPTNPBWR1PTGS1PTGS2HPGD | |
| SCHEMBL2649535 | 0.85 | GAA (0.43) | MAPTTP53PTGS1PTGS2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL2662511 | 0.85 | PTGS2 (0.44) | MAPTNPBWR1PTGS1PTGS2HPGD | |
| SCHEMBL2650198 | 0.84 | PSD (0.42) | POLBMAPTPSDPTGS2ALDH1A1 | |
| SCHEMBL2650368 | 0.83 | GAA (0.40) | POLBMAPTPTGS1PTGS2ALDH1A1 | |
| SCHEMBL2649011 | 0.83 | GAA (0.40) | POLBMAPTPSDPTGS2ALDH1A1 | |
| SCHEMBL2648540 | 0.83 | GAA (0.40) | POLBMAPTPSDPTGS1PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6333336-B1 | GAMMA-AMINOBUTYRIC ACID RECEPTORS AS ANTICONVULSANTS FORMING THE COMPOUND BY AMIDATION | MERCK SHARP & DOHME LTD. (GB) | 2001-12-25 | — | — | US | disclosed |