Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 2/20 | 0.31 |
| ▸ | HTR2C | P28335 | 2/20 | 0.31 |
| ▸ | HTR2B | P41595 | 2/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | PGR | P06401 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4977025 | 0.84 | SLC18A3 (0.44) | SLC18A3TAAR1HTR2AHTR2CHTR2B | |
| SCHEMBL27569730 | 0.77 | CHRNA7 (0.45) | TDP1 | |
| SCHEMBL15951814 | 0.76 | ADRB2 (0.37) | HTR2AHTR2CHTR2B | |
| SCHEMBL10958845 | 0.76 | SLC18A3 (0.39) | SLC18A3TAAR1ESR1 | |
| SCHEMBL11464906 | 0.74 | HTR1A (0.47) | HTR2AHTR2CHTR2B | |
| SCHEMBL10625781 | 0.73 | CA1 (0.34) | HTR2AHTR2CHTR2BTDP1 | |
| SCHEMBL27588297 | 0.71 | CHRM5 (0.42) | TAAR1TDP1 | |
| SCHEMBL1666925 | 0.70 | HTR2C (0.33) | TAAR1HTR2AHTR2CHTR2B | |
| SCHEMBL10409483 | 0.70 | SLC6A2 (0.40) | TAAR1HTR2AHTR2CHTR2BTDP1 | |
| SCHEMBL404339 | 0.70 | TAAR1 (0.44) | TAAR1TDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2488503-A1 | AMINO - PYRIMIDINE COMPOUNDS AS INHIBITORS OF TBKL AND/OR IKK EPSILON | Myrexis, Inc. (US) | 2012-08-22 | — | — | EP | claimed |
| WO-2011046970-A1 | AMINO - PYRIMIDINE COMPOUNDS AS INHIBITORS OF TBKL AND/OR IKK EPSILON | MYREXIS, INC. (US) | 2011-04-21 | — | — | WO | claimed |
| EP-2488503-A1 | AMINO - PYRIMIDINE COMPOUNDS AS INHIBITORS OF TBKL AND/OR IKK EPSILON | Myrexis, Inc. (US) | 2012-08-22 | — | — | EP | disclosed |