Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | JAK2 | O60674 | 4/20 | 0.41 |
| ▸ | JAK1 | P23458 | 4/20 | 0.41 |
| ▸ | TYK2 | P29597 | 4/20 | 0.41 |
| ▸ | JAK3 | P52333 | 4/20 | 0.41 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17258893 | 0.87 | ALDH1A1 (0.53) | TP53GAAKMT2AALDH1A1HPGD | |
| SCHEMBL21048781 | 0.84 | C5AR1 (0.50) | GAAKMT2AALDH1A1PTGER1HTT | |
| SCHEMBL21048854 | 0.84 | PTGER1 (0.44) | TP53GAAKMT2AALDH1A1HPGD | |
| SCHEMBL17258939 | 0.79 | TP53 (0.50) | TP53GAAKMT2AALDH1A1JAK2 | |
| SCHEMBL21048978 | 0.78 | TP53 (0.52) | TP53GAAKMT2AALDH1A1HPGD | |
| SCHEMBL28840926 | 0.77 | TP53 (0.48) | TP53KMT2AJAK2JAK1TYK2 | |
| SCHEMBL21048817 | 0.75 | PGR (0.54) | GAAKMT2AHPGDPTGER1 | |
| SCHEMBL27682450 | 0.73 | ALDH1A1 (0.53) | GAAKMT2AALDH1A1HPGDHTT | |
| Hydrochloric Acid SCHEMBL21048875 | 0.73 | ALOX5AP (0.38) | KMT2AALDH1A1JAK2JAK1TYK2 | |
| SCHEMBL29935885 | 0.73 | CYP1A2 (0.55) | GAAKMT2AALDH1A1HPGDHTT |
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-3143021-B1 | PYRAZOLOPYRIDINES AND PYRAZOLOPYRIMIDINES | PFIZER (US) | 2019-06-12 | — | — | EP | disclosed |