Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | PARP10 | Q53GL7 | 3/20 | 0.41 |
| ▸ | PARP1 | P09874 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.41 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 2/20 | 0.36 |
| ▸ | HTR1D | P28221 | 2/20 | 0.36 |
| ▸ | HTR2C | P28335 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL17474254 | 0.84 | HTR1A (0.42) | MAPK1PARP10PARP1PARP2PARP4 | |
| SCHEMBL2977013 | 0.81 | HSD17B10 (0.42) | MAPK1PARP10PARP1SLC6A2SLC6A4 | |
| SCHEMBL27467963 | 0.80 | HTR1A (0.40) | MAPK1PARP10PARP1PARP2PARP4 | |
| SCHEMBL5006032 | 0.79 | MAPK1 (0.45) | MAPK1PARP10PARP1CA1CA2 | |
| SCHEMBL5183184 | 0.79 | MAPK1 (0.41) | MAPK1PARP10SLC6A3TSHRALDH1A1 | |
| SCHEMBL2967220 | 0.79 | GABRP (0.44) | MAPK1PARP10SLC6A3ALDH1A1HDAC6 | |
| SCHEMBL364447 | 0.78 | TSHR (0.53) | PARP1PARP2SLC6A3TSHRALDH1A1 | |
| SCHEMBL28352954 | 0.78 | HTR1A (0.42) | MAPK1PARP1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL20981385 | 0.77 | MEN1 (0.43) | MAPK1SLC6A3ALDH1A1HDAC6MEN1 | |
| SCHEMBL28960637 | 0.77 | HTR1A (0.58) | MAPK1PARP1SLC6A2SLC6A4SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2350029-A1 | 3-HYDROQUINAZOLIN-4-ONE DERIVATIVES FOR USE AS STEAROYL COA DESATURASE INHIBITORS | Gilead Sciences, Inc. (US) | 2011-08-03 | — | — | EP | disclosed |