Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.55 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL10323931 | 0.75 | SMN1; SMN2 (0.63) | ALDH1A1SMN1; SMN2HPGDMEN1KMT2A | |
| SCHEMBL10324159 | 0.73 | CYP1A2 (0.55) | ALDH1A1SMN1; SMN2HPGDMEN1KMT2A | |
| SCHEMBL10323933 | 0.73 | CYP1A2 (0.55) | ALDH1A1SMN1; SMN2HPGDMEN1KMT2A | |
| SCHEMBL11297711 | 0.73 | NPC1 (0.80) | ALDH1A1SMN1; SMN2HPGDMEN1KMT2A | |
| SCHEMBL11299002 | 0.72 | ALDH1A1 (0.62) | ALDH1A1SMN1; SMN2HPGDMEN1KMT2A | |
| SCHEMBL14427603 | 0.70 | MEN1 (0.66) | ALDH1A1SMN1; SMN2HPGDMEN1KMT2A | |
| SCHEMBL11528622 | 0.70 | MAPT (0.54) | ALDH1A1SMN1; SMN2HPGDMEN1KMT2A | |
| SCHEMBL8516064 | 0.69 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2HPGDMEN1KMT2A | |
| SCHEMBL11544217 | 0.69 | HPGD (0.78) | ALDH1A1SMN1; SMN2HPGDMEN1KMT2A | |
| SCHEMBL1006444 | 0.69 | HTT (0.71) | ALDH1A1SMN1; SMN2HPGDMEN1KMT2A |
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-2012098065-A1 | PYRIDO PYRIMIDINES FOR USE AS DYRK1 INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2012-07-26 | — | — | WO | disclosed |