Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 11/20 | 0.36 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | ABCC9 | O60706 | 3/20 | 0.34 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.34 |
| ▸ | TNKS | O95271 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9376492 | 0.81 | PPIB (0.41) | PDPK1ABCB1TNKS | |
| SCHEMBL9682834 | 0.78 | PDPK1 (0.39) | PDPK1ABCB1MCL1ABCC9MALT1 | |
| SCHEMBL9476814 | 0.75 | BACE1 (0.32) | ABCB1ABCC9 | |
| SCHEMBL9376866 | 0.75 | PDPK1 (0.34) | PDPK1ABCB1ABCC9 | |
| SCHEMBL9475150 | 0.73 | METAP2 (0.40) | — | |
| SCHEMBL9478589 | 0.72 | CYP11B2 (0.46) | ABCC9 | |
| SCHEMBL9476301 | 0.71 | SMO (0.39) | ABCB1MAP3K5ABCC9MALT1 | |
| SCHEMBL9372439 | 0.71 | ABCC9 (0.39) | ABCB1ABCC9MALT1 | |
| SCHEMBL9375996 | 0.71 | ABCB1 (0.36) | ABCB1ABCC9MALT1 | |
| SCHEMBL9476318 | 0.70 | ABCC9 (0.34) | ABCB1ABCC9 |
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-5036068-A | Cardiovascular disorders | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-07-30 | — | — | US | disclosed |