Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLKB1 | P03952 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL23843221 | 0.84 | KLKB1 (0.43) | KLKB1KDM4EALDH1A1HSD17B10CYP2D6 | |
| SCHEMBL23769341 | 0.77 | KLKB1 (0.44) | KLKB1KDM4EALDH1A1HSD17B10CYP2D6 | |
| SCHEMBL23768901 | 0.77 | KLKB1 (0.44) | KLKB1KDM4EALDH1A1HSD17B10CYP2D6 | |
| SCHEMBL23768898 | 0.74 | KLKB1 (0.49) | KLKB1KDM4EL3MBTL1ALDH1A1HSD17B10 | |
| SCHEMBL23769184 | 0.73 | KLKB1 (0.35) | KLKB1 | |
| SCHEMBL23768852 | 0.72 | KLKB1 (0.45) | KLKB1KDM4EALDH1A1HSD17B10CYP2D6 | |
| SCHEMBL23769681 | 0.72 | KLKB1 (0.46) | KLKB1L3MBTL1HSD17B10 | |
| SCHEMBL23769356 | 0.71 | KLKB1 (0.43) | KLKB1KDM4EL3MBTL1 | |
| SCHEMBL23754040 | 0.69 | TRPV3 (0.34) | KLKB1ALDH1A1HSD17B10CYP2D6HPGD | |
| SCHEMBL31357730 | 0.69 | TRPV3 (0.34) | KLKB1ALDH1A1HSD17B10CYP2D6HPGD |
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 |