Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.58 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.58 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.56 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 3/20 | 0.54 |
| ▸ | HTT | P42858 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | RXRA | P19793 | 1/20 | 0.49 |
| ▸ | RXRB | P28702 | 1/20 | 0.49 |
| ▸ | RXRG | P48443 | 1/20 | 0.49 |
| ▸ | ANPEP | P15144 | 1/20 | 0.48 |
| ▸ | ENPEP | Q07075 | 1/20 | 0.48 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL104746 | 0.95 | CA2 (0.62) | CA2CAMK2AAKR1B1CTBP2GAA | |
| Methane SCHEMBL1421956 | 0.93 | CA2 (0.60) | CA2CAMK2AAKR1B1CTBP2GAA | |
| Hydrochloric Acid SCHEMBL2170212 | 0.93 | CA2 (0.60) | CA2CAMK2AAKR1B1CTBP2GAA | |
| Fluoride SCHEMBL11185179 | 0.93 | CA2 (0.60) | CA2CAMK2AAKR1B1CTBP2GAA | |
| SCHEMBL538299 | 0.89 | LMNA (0.69) | CA2CAMK2AAKR1B1CTBP2GAA | |
| Methane SCHEMBL10453233 | 0.87 | LMNA (0.67) | CA2CAMK2AAKR1B1CTBP2GAA | |
| SCHEMBL5455400 | 0.84 | GAA (0.59) | CA2CAMK2AAKR1B1CTBP2GAA | |
| SCHEMBL3500048 | 0.84 | SRD5A2 (0.62) | CA2CAMK2AAKR1B1CTBP2GAA | |
| SCHEMBL69614 | 0.83 | CA2 (0.79) | CA2CAMK2AAKR1B1GAAHTT | |
| Toluene SCHEMBL10858409 | 0.82 | AKR1B1 (0.57) | CA2CAMK2AAKR1B1CTBP2GAA |
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-2266958-B1 | Antiviral agent | SHIONOGI & CO (JP) | 2017-03-15 | — | — | EP | disclosed |