Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5268265 | 0.88 | TDP1 (0.47) | ALDH1A1TDP1MAPTSMN1; SMN2POLB | |
| SCHEMBL13816897 | 0.83 | TDP1 (0.51) | ALDH1A1TDP1MAPTSMN1; SMN2POLB | |
| SCHEMBL5269241 | 0.83 | POLB (0.53) | ALDH1A1MAPTSMN1; SMN2POLBRAB9A | |
| SCHEMBL5269803 | 0.82 | HPGD (0.48) | ALDH1A1TDP1MAPTSMN1; SMN2POLB | |
| SCHEMBL5269055 | 0.82 | TSHR (0.57) | ALDH1A1TDP1MAPTSMN1; SMN2POLB | |
| SCHEMBL5265233 | 0.82 | ALDH1A1 (0.44) | ALDH1A1MAPTSMN1; SMN2POLBHPGD | |
| SCHEMBL5267096 | 0.81 | POLB (0.49) | ALDH1A1TDP1SMN1; SMN2POLBRAB9A | |
| SCHEMBL5266740 | 0.81 | TDP1 (0.49) | ALDH1A1TDP1MAPTSMN1; SMN2POLB | |
| SCHEMBL5272917 | 0.81 | RAB9A (0.57) | ALDH1A1TDP1MAPTSMN1; SMN2POLB | |
| SCHEMBL5266021 | 0.81 | GAA (0.49) | ALDH1A1TDP1MAPTSMN1; SMN2POLB |
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-1847531-A1 | PYRAZOLE COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2007-10-24 | — | — | EP | disclosed |