Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNQ3 | O43525 | 1/20 | 0.32 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.32 |
| ▸ | KCNQ4 | P56696 | 1/20 | 0.32 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17209554 | 0.76 | NPC1 (0.54) | NPC1 | |
| SCHEMBL17206300 | 0.73 | CNR2 (0.42) | KCNQ3KCNQ2KCNQ4KCNQ5 | |
| SCHEMBL17209758 | 0.72 | NR4A2 (0.41) | NPC1NR4A2KCNH2 | |
| SCHEMBL17206324 | 0.72 | CNR2 (0.56) | — | |
| SCHEMBL18520224 | 0.70 | KCNQ3 (0.42) | KCNQ3KCNQ2KCNQ4KCNQ5NPC1 | |
| SCHEMBL17206332 | 0.69 | TAS1R3 (0.58) | NPC1 | |
| SCHEMBL17205222 | 0.69 | TAS1R3 (0.58) | NPC1 | |
| SCHEMBL17205524 | 0.68 | KDM4E (0.46) | NR4A2 | |
| SCHEMBL17209765 | 0.68 | KDM4E (0.47) | NR4A2KCNH2 | |
| SCHEMBL18520715 | 0.63 | KDM4E (0.37) | NR4A2KCNH2 |
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-2016171743-A1 | INHIBITORS OF DRUG-RESISTANT MYCOBACTERIUM TUBERCULOSIS | THE JOHNS HOPKINS UNIVERSITY (US) | 2016-10-27 | — | — | WO | disclosed |