Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | SCD | O00767 | 1/20 | 0.34 |
| ▸ | NT5E | P21589 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ITPR3 | Q14573 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP8 | P22894 | 1/20 | 0.33 |
| ▸ | MMP13 | P45452 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MIF | P14174 | 1/20 | 0.32 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.32 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.32 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13662234 | 0.87 | KCNH2 (0.43) | KCNH2CYP3A4SCDNT5EMAPT | |
| SCHEMBL13662226 | 0.87 | KCNH2 (0.43) | KCNH2CYP3A4SCDNT5EMAPT | |
| SCHEMBL18116829 | 0.85 | KCNH2 (0.44) | KCNH2CYP3A4SCDNT5EMAPT | |
| SCHEMBL18116827 | 0.79 | KCNH2 (0.45) | KCNH2CYP3A4NT5EMAPTMEN1 | |
| SCHEMBL13662233 | 0.78 | NT5E (0.41) | KCNH2CYP3A4NT5EMAPTMEN1 | |
| SCHEMBL13663814 | 0.78 | NT5E (0.41) | KCNH2CYP3A4NT5EMAPTMEN1 | |
| SCHEMBL25457426 | 0.76 | KCNH2 (0.46) | KCNH2NT5EMAPTMEN1USP2 | |
| SCHEMBL20353098 | 0.75 | KCNH2 (0.44) | KCNH2CYP3A4NT5EMAPTMEN1 | |
| SCHEMBL18638161 | 0.75 | LMNA (0.36) | KCNH2SCDMAPTALDH1A1LMNA | |
| SCHEMBL13637126 | 0.74 | JAK2 (0.41) | KCNH2MAPTALDH1A1LMNASMN1; 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-3141905-A1 | PROTEIN LABELING WITH CYANOBENZOTHIAZOLE CONJUGATES | Promega Corporation (US) | 2017-03-15 | — | — | EP | disclosed |