Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.33 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.33 |
| ▸ | GSK3A | P49840 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | TNIK | Q9UKE5 | 2/20 | 0.33 |
| ▸ | BRAF | P15056 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.32 |
| ▸ | OXTR | P30559 | 1/20 | 0.32 |
| ▸ | SLC22A12 | Q96S37 | 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 | |
|---|---|---|---|---|
| SCHEMBL3395407 | 0.80 | KCNH2 (0.40) | KCNH2CYP19A1CYP11B1CYP11B2GSK3A | |
| SCHEMBL3433175 | 0.78 | KCNH2 (0.47) | KCNH2PIM1PIM3PIM2BRAF | |
| SCHEMBL3434686 | 0.75 | KCNH2 (0.44) | KCNH2CYP19A1CYP11B1CYP11B2GSK3A | |
| SCHEMBL3432960 | 0.75 | KCNH2 (0.43) | KCNH2CYP19A1CYP11B1CYP11B2TNIK | |
| Hydrochloric Acid SCHEMBL3395604 | 0.74 | KCNH2 (0.43) | KCNH2CYP19A1CYP11B1CYP11B2GSK3A | |
| SCHEMBL3393481 | 0.74 | MAPT (0.38) | CYP11B1CYP11B2TNIKRAB9ALRRK2 | |
| Hydrochloric Acid SCHEMBL3432843 | 0.74 | KCNH2 (0.42) | KCNH2CYP11B1CYP11B2TNIKLRRK2 | |
| SCHEMBL3392062 | 0.72 | KCNH2 (0.54) | KCNH2LRRK2 | |
| SCHEMBL3392275 | 0.72 | KCNH2 (0.46) | KCNH2LRRK2OXTR | |
| SCHEMBL3434435 | 0.72 | KCNH2 (0.33) | KCNH2CYP19A1PIM1PIM3PIM2 |
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-2010046780-A2 | ANTI VIRAL COMPOUNDS | INSTITUT PASTEUR KOREA (KR) | 2010-04-29 | — | — | WO | disclosed |