Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HCAR1 | Q9BXC0 | 3/20 | 0.33 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.32 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.32 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.32 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.32 |
| ▸ | KIF20B | Q96Q89 | 1/20 | 0.31 |
| ▸ | XPO1 | O14980 | 1/20 | 0.31 |
| ▸ | CCR4 | P51679 | 1/20 | 0.31 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.30 |
| ▸ | TRPV1 | Q8NER1 | 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 | |
|---|---|---|---|---|
| SCHEMBL9954818 | 0.79 | ALDH1A1 (0.41) | CYP11B2ALDH1A1 | |
| SCHEMBL438099 | 0.77 | TDP1 (0.35) | CYP11B1CYP11B2HCAR1XPO1 | |
| SCHEMBL25329429 | 0.75 | NFKB1 (0.36) | CYP11B1CYP11B2KCNQ3KCNQ2KCNE1 | |
| SCHEMBL3656007 | 0.69 | KDM4E (0.50) | ALDH1A1KIF20B | |
| SCHEMBL10285853 | 0.69 | MAPT (0.40) | ALDH1A1XPO1 | |
| SCHEMBL9954808 | 0.68 | NPC1 (0.39) | ALDH1A1CCR4 | |
| SCHEMBL15543205 | 0.68 | CCR4 (0.41) | CYP11B1CYP11B2ALDH1A1CCR4 | |
| SCHEMBL29590019 | 0.68 | CCR4 (0.41) | CYP11B1CYP11B2ALDH1A1CCR4 | |
| SCHEMBL20969588 | 0.68 | MPL (0.35) | CYP11B1CYP11B2ALDH1A1XPO1 | |
| SCHEMBL9078450 | 0.67 | ALDH1A1 (0.39) | ALDH1A1HCAR1CCR4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102388044-A | Heterocyclic inhibitors of histamine receptors for the treatment of diseases | KALYPSYS INC | 2012-03-21 | — | — | CN | disclosed |