Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | MGLL | Q99685 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | PLG | P00747 | 1/20 | 0.35 |
| ▸ | F12 | P00748 | 1/20 | 0.35 |
| ▸ | F11 | P03951 | 1/20 | 0.35 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.35 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.35 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.35 |
| ▸ | ENPP2 | Q13822 | 3/20 | 0.34 |
| ▸ | ABL1 | P00519 | 2/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.32 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.32 |
| ▸ | KCNK9 | Q9NPC2 | 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 | |
|---|---|---|---|---|
| SCHEMBL2644507 | 1.00 | CA1 (0.44) | CA1CA2MGLLKDM4EALDH1A1 | |
| SCHEMBL2644418 | 0.88 | CA1 (0.44) | CA1CA2MGLLKDM4EALDH1A1 | |
| SCHEMBL29953669 | 0.88 | CA1 (0.44) | CA1CA2MGLLKDM4EALDH1A1 | |
| SCHEMBL29956833 | 0.83 | CA1 (0.42) | CA1CA2MGLLKDM4EALDH1A1 | |
| SCHEMBL29954377 | 0.79 | ENPP2 (0.49) | CA1CA2KDM4EALDH1A1HSD17B10 | |
| SCHEMBL31435060 | 0.79 | HSD17B1 (0.42) | KDM4EALDH1A1HSD17B10CYP11B1CYP11B2 | |
| SCHEMBL29956955 | 0.78 | CA1 (0.44) | CA1CA2MGLLKDM4EALDH1A1 | |
| SCHEMBL29950999 | 0.76 | MGLL (0.49) | CA1CA2MGLLKDM4EALDH1A1 | |
| SCHEMBL2644734 | 0.76 | ALPL (0.41) | KDM4EALDH1A1HSD17B10SLC40A1 | |
| SCHEMBL16298508 | 0.76 | CYP1A2 (0.52) | KDM4EALDH1A1HSD17B10KCNK3KCNK9 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |