Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | GSTO1 | P78417 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 3/20 | 0.33 |
| ▸ | FEN1 | P39748 | 3/20 | 0.33 |
| ▸ | KCNJ6 | P48051 | 2/20 | 0.33 |
| ▸ | KCNJ5 | P48544 | 2/20 | 0.33 |
| ▸ | KCNJ3 | P48549 | 2/20 | 0.33 |
| ▸ | PDE2A | O00408 | 1/20 | 0.33 |
| ▸ | PDE5A | O76074 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | APEX1 | P27695 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4324011 | 0.81 | ALDH1A1 (0.45) | ALDH1A1HTTSMN1; SMN2POLBKCNJ6 | |
| SCHEMBL28017305 | 0.79 | CCR2 (0.33) | — | |
| SCHEMBL5449834 | 0.76 | ALDH1A1 (0.44) | ALDH1A1HTTGSTO1SMN1; SMN2POLB | |
| SCHEMBL8901063 | 0.75 | TET2 (0.33) | — | |
| SCHEMBL4574416 | 0.75 | CA2 (0.34) | — | |
| SCHEMBL21408564 | 0.73 | GSTO1 (0.44) | ALDH1A1HTTGSTO1SMN1; SMN2POLB | |
| SCHEMBL30828303 | 0.72 | ALDH1A1 (0.53) | ALDH1A1HTTSMN1; SMN2POLBALOX5AP | |
| SCHEMBL5447959 | 0.71 | TSHR (0.44) | ALDH1A1HTTGSTO1SMN1; SMN2POLB | |
| SCHEMBL182553 | 0.67 | ALDH1A1 (0.54) | ALDH1A1HTTSMN1; SMN2POLBLMNA | |
| SCHEMBL1476654 | 0.67 | ALDH1A1 (0.40) | ALDH1A1POLBCYP3A4ALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107406421-A | SGC STIMULATORS | 铁木医药有限公司 | 2017-11-28 | — | — | CN | disclosed |