Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 7/20 | 0.37 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.36 |
| ▸ | HTR1B | P28222 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 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 | |
|---|---|---|---|---|
| SCHEMBL5469275 | 0.81 | MAPT (0.43) | ALDH1A1TSHRCYP3A4RECQLKMT2A | |
| SCHEMBL2367117 | 0.79 | TSHR (0.47) | ALDH1A1TSHRKMT2AMAPT | |
| SCHEMBL4432103 | 0.76 | ALDH1A1 (0.35) | ALDH1A1CYP3A4KMT2AMAPTMEN1 | |
| SCHEMBL1464248 | 0.76 | ALDH1A1 (0.37) | ALDH1A1TSHRCYP3A4RECQLKMT2A | |
| SCHEMBL5452217 | 0.76 | MAPT (0.41) | ALDH1A1TSHRCYP3A4KMT2AHPGD | |
| SCHEMBL30467840 | 0.75 | ALDH1A1 (0.46) | ALDH1A1TSHRRECQLKMT2AHPGD | |
| SCHEMBL4988735 | 0.75 | ALDH1A1 (0.46) | ALDH1A1TSHRRECQLKMT2AHPGD | |
| SCHEMBL20707091 | 0.75 | ALDH1A1 (0.55) | ALDH1A1TSHRCYP3A4RECQLKMT2A | |
| SCHEMBL18353863 | 0.74 | KMT2A (0.45) | ALDH1A1CYP3A4KMT2AHPGDMAPT | |
| SCHEMBL14659292 | 0.74 | DUT (0.32) | ALDH1A1TSHRCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2132184-A1 | NOVEL PYRIMIDINE DERIVATIVES 698 | AstraZeneca AB (SE) | 2009-12-16 | — | — | EP | disclosed |
| WO-2008104754-A1 | NOVEL PYRIMIDINE DERIVATIVES 698 | ASTRAZENECA AB (SE) | 2008-09-04 | — | — | WO | disclosed |