Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 4/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL360696 | 0.95 | ALDH1A1 (0.54) | THRBALDH1A1GAAMAPTPOLB | |
| SCHEMBL359187 | 0.95 | ALDH1A1 (0.54) | THRBALDH1A1GAAMAPTPOLB | |
| SCHEMBL14916777 | 0.83 | THRB (0.34) | THRBALDH1A1GAAMAPTPOLB | |
| SCHEMBL17247577 | 0.81 | GAA (0.57) | THRBALDH1A1GAAMAPTKDM4E | |
| SCHEMBL14953161 | 0.80 | POLB (0.31) | THRBALDH1A1GAAMAPTPOLB | |
| SCHEMBL360190 | 0.80 | THRB (0.33) | THRBALDH1A1GAAMAPTPOLB | |
| SCHEMBL15690208 | 0.80 | THRB (0.36) | THRBALDH1A1GAAPOLBKDM4E | |
| SCHEMBL360133 | 0.80 | THRB (0.32) | THRBALDH1A1GAAPOLBTP53 | |
| SCHEMBL14953110 | 0.79 | POLB (0.46) | THRBALDH1A1GAAMAPTPOLB | |
| SCHEMBL14953235 | 0.79 | THRB (0.34) | THRBALDH1A1GAAMAPTPOLB |
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-2012008528-A1 | PYRAZOLE COMPOUND | 大日本住友製薬株式会社 (JP) | 2012-01-19 | — | — | WO | disclosed |