Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | RXRA | P19793 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | FLT1 | P17948 | 2/20 | 0.38 |
| ▸ | KDR | P35968 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.38 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19002057 | 0.86 | KLKB1 (0.48) | PDE2AALDH1A1TSHRKCNH2KLKB1 | |
| SCHEMBL18987214 | 0.83 | ALDH1A1 (0.43) | PDE2AALDH1A1SLC6A4SLC6A3TSHR | |
| SCHEMBL18987207 | 0.79 | KLKB1 (0.44) | PDE2ASLC6A4SLC6A3FLT1KDR | |
| SCHEMBL15336436 | 0.76 | GAA (0.49) | ALDH1A1SLC6A3TSHR | |
| SCHEMBL18618794 | 0.75 | SLC6A4 (0.43) | ALDH1A1SLC6A4SLC6A3TSHRBCHE | |
| SCHEMBL10195727 | 0.74 | HRH3 (0.43) | ALDH1A1 | |
| SCHEMBL9061480 | 0.73 | BCHE (0.56) | ALDH1A1SLC6A4SLC6A3TSHRGRIN2B | |
| SCHEMBL19120099 | 0.72 | RXRA (0.51) | PDE2AALDH1A1RXRAGRIN1GRIN2B | |
| SCHEMBL13740686 | 0.71 | SCN5A (0.48) | ALDH1A1SLC6A4SLC6A3TSHRFLT1 | |
| SCHEMBL23989363 | 0.71 | LMNA (0.36) | ALDH1A1KCNH2KLKB1 |
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-2017103615-A1 | COMBINATION PRODUCT | LIVERPOOL SCHOOL OF TROPICAL MEDICINE (GB) | 2017-06-22 | — | — | WO | disclosed |