Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.57 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | CNR2 | P34972 | 2/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL11050724 | 0.80 | ALDH1A1 (0.58) | PKMALDH1A1FGFR1HPGDMAPT | |
| SCHEMBL4748504 | 0.78 | PKM (0.77) | PKMALDH1A1FGFR1HPGDNR1I2 | |
| SCHEMBL10736771 | 0.77 | MAPT (0.48) | PKMALDH1A1FGFR1HPGDMAPT | |
| SCHEMBL6529410 | 0.76 | CYP11B1 (0.53) | ALDH1A1HTTLMNASMN1; SMN2 | |
| SCHEMBL2841823 | 0.76 | PKM (1.00) | PKMALDH1A1FGFR1HPGDMAPT | |
| SCHEMBL5656026 | 0.74 | PKM (0.44) | PKMALDH1A1HPGDMAPTKMT2A | |
| SCHEMBL3342620 | 0.73 | ALDH1A1 (1.00) | PKMALDH1A1FGFR1HPGDMAPT | |
| SCHEMBL3055818 | 0.73 | PKM (0.69) | PKMALDH1A1FGFR1HPGDMAPT | |
| SCHEMBL30229258 | 0.71 | PKM (0.62) | PKMALDH1A1FGFR1MAPTNR1I2 | |
| SCHEMBL16401986 | 0.71 | ALDH1A1 (0.46) | PKMALDH1A1FGFR1HPGDMAPT |
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-0843671-A1 | HETEROCYCLIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | GLAXO GROUP LIMITED (GB) | 1998-05-27 | — | — | EP | disclosed |
| WO-1997003069-A1 | HETEROCYCLIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | GLAXO GROUP LIMITED (GB) | 1997-01-30 | — | — | WO | disclosed |