Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 13/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.44 |
| ▸ | MAPT | P10636 | 6/20 | 0.44 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.44 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 5/20 | 0.43 |
| ▸ | RAB9A | P51151 | 6/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.37 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7375055 | 0.70 | PKM (0.38) | KDM4EALDH1A1HPGDHSD17B10CACNA1B | |
| SCHEMBL9533593 | 0.70 | NPC1 (0.40) | KDM4EALDH1A1MAPTHPGDRAB9A | |
| SCHEMBL16473318 | 0.70 | KDM4E (0.53) | KDM4EALDH1A1MAPTCHEK1LIMK1 | |
| SCHEMBL7383037 | 0.69 | CACNA1B (0.36) | KDM4EHSD17B10CACNA1BCASP1 | |
| SCHEMBL7410687 | 0.69 | CACNA1B (0.61) | ALDH1A1MAPTMEN1KMT2AMAPK1 | |
| SCHEMBL9806876 | 0.68 | KDM4E (0.71) | KDM4EALDH1A1MAPTHPGDRAB9A | |
| SCHEMBL20559166 | 0.68 | KDM4E (0.44) | KDM4EALDH1A1MAPTCHEK1LIMK1 | |
| SCHEMBL22623673 | 0.67 | CA2 (0.47) | KDM4EALDH1A1MAPTCHEK1LIMK1 | |
| SCHEMBL22623812 | 0.67 | CA2 (0.47) | KDM4EALDH1A1MAPTCHEK1LIMK1 | |
| SCHEMBL20455586 | 0.65 | KDM4E (0.47) | KDM4EALDH1A1MAPTCHEK1LIMK1 |
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-4735956-A | Certain 1,4-dihydro-2,6-di-lower hydrocarbyl-4-heterocyclic-3,5-pyridine dicarboxylates which are useful as calcium channel blockers | MERCK & CO., INC. (US) | 1988-04-05 | — | — | US | disclosed |