Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.40 |
| ▸ | HTR4 | Q13639 | 4/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL3346862 | 0.89 | ALDH1A1 (0.39) | ALDH1A1MAPTALDH1A3HTR4ADORA2B | |
| SCHEMBL3344767 | 0.88 | ALDH1A1 (0.39) | ALDH1A1MAPTHTR4ADORA2BKDM4E | |
| SCHEMBL20591936 | 0.82 | ALDH1A1 (0.48) | ALDH1A1MAPTALDH1A3ADRA1DADRA1A | |
| SCHEMBL2726089 | 0.80 | ALDH1A1 (0.48) | ALDH1A1MAPTHTR4ADORA2BKDM4E | |
| SCHEMBL3345838 | 0.79 | ALDH1A1 (0.48) | ALDH1A1MAPTKDM4ELMNAHTT | |
| SCHEMBL1911914 | 0.77 | DRD2 (0.53) | ALDH1A1MAPTDRD2KDM4EHTT | |
| SCHEMBL20764155 | 0.77 | MAPT (0.58) | ALDH1A1MAPTALDH1A3KDM4ELMNA | |
| SCHEMBL10810169 | 0.76 | ALDH1A1 (0.57) | ALDH1A1MAPTALDH1A3KDM4ELMNA | |
| SCHEMBL1193917 | 0.75 | DRD2 (0.64) | ALDH1A1MAPTADRA1DADRA1AADRA1B | |
| SCHEMBL3346311 | 0.75 | KDM4E (0.36) | ALDH1A1MAPTALDH1A3ADRA1DADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010049731-A1 | PYRAZOLO- AND IMIDAZOPYRIDINYLPYRIMIDINEAMINES AS IGF-1R TYROSINE KINASE INHIBITORS | ASTRAZENECA AB (SE) | 2010-05-06 | — | — | WO | disclosed |