Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.36 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.36 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.36 |
| ▸ | GCGR | P47871 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | COPS5 | Q92905 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL2486303 | 0.85 | GAA (0.42) | KMT2AALDH1A1GAASMN1; SMN2AKT3 | |
| SCHEMBL2158016 | 0.80 | AVPR2 (0.36) | KMT2AALDH1A1SMN1; SMN2RAB9ACYP2D6 | |
| SCHEMBL2486305 | 0.80 | ECE1 (0.38) | KMT2ASMN1; SMN2RAB9ACYP2D6 | |
| SCHEMBL3814717 | 0.69 | AVPR2 (0.35) | KMT2AALDH1A1GAASMN1; SMN2SLC6A2 | |
| SCHEMBL3816559 | 0.64 | KMT2A (0.34) | KMT2ACYP2D6 | |
| SCHEMBL2158331 | 0.63 | TSHR (0.39) | ALDH1A1SMN1; SMN2HTTSLC6A2SLC6A4 | |
| SCHEMBL6550957 | 0.62 | KMT2A (1.00) | KMT2AALDH1A1GAA | |
| SCHEMBL2158689 | 0.61 | CYP1A2 (0.40) | SMN1; SMN2CYP2D6 | |
| SCHEMBL19894123 | 0.61 | KCNMA1 (0.48) | KMT2AALDH1A1SMN1; SMN2HTTRAB9A | |
| SCHEMBL2157466 | 0.60 | IKBKB (0.42) | SMN1; SMN2 |
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-2206709-A2 | Thiophene derivatives as antiviral agents for flavivirus infection | Virochem Pharma Inc. (CA) | 2010-07-14 | — | — | EP | claimed |