Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | KLKB1 | P03952 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.33 |
| ▸ | RORC | P51449 | 2/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23769471 | 0.90 | NOTUM (0.39) | NOTUMKLKB1GABRA2GABRB2 | |
| SCHEMBL23754015 | 0.86 | KLKB1 (0.48) | NOTUMKLKB1ALDH1A1TDP1GABRA2 | |
| SCHEMBL23769409 | 0.81 | GRM2 (0.39) | KLKB1ALDH1A1TDP1HPGDALOX15 | |
| SCHEMBL10570251 | 0.78 | ALDH1A1 (0.48) | NOTUMALDH1A1TDP1GABRA2GABRB2 | |
| SCHEMBL23754014 | 0.77 | NOTUM (0.49) | NOTUMKLKB1ALDH1A1GABRA2GABRB2 | |
| SCHEMBL23754039 | 0.77 | KLKB1 (0.47) | NOTUMKLKB1ALDH1A1GABRA2GABRB2 | |
| SCHEMBL23754033 | 0.75 | KLKB1 (0.46) | NOTUMKLKB1ALDH1A1GABRA2GABRB2 | |
| SCHEMBL29906606 | 0.75 | KLKB1 (0.46) | NOTUMKLKB1ALDH1A1GABRA2GABRB2 | |
| SCHEMBL23754350 | 0.75 | KLKB1 (0.62) | NOTUMKLKB1 | |
| SCHEMBL29906552 | 0.75 | KLKB1 (0.62) | NOTUMKLKB1 |
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-2021160718-A1 | HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2021-08-19 | — | — | WO | disclosed |