Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | ABCC9 | O60706 | 12/20 | 0.39 |
| ▸ | KCNJ11 | Q14654 | 12/20 | 0.39 |
| ▸ | ABCC8 | Q09428 | 9/20 | 0.39 |
| ▸ | KCNJ8 | Q15842 | 9/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.35 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28969773 | 1.00 | ALDH1A1 (0.42) | ALDH1A1ABCC9KCNJ11ABCC8KCNJ8 | |
| SCHEMBL30266788 | 0.88 | ALDH1A1 (0.39) | ALDH1A1ABCC9KCNJ11ABCC8KCNJ8 | |
| SCHEMBL24122313 | 0.88 | ALDH1A1 (0.39) | ALDH1A1ABCC9KCNJ11ABCC8KCNJ8 | |
| SCHEMBL24116780 | 0.88 | ALDH1A1 (0.39) | ALDH1A1ABCC9KCNJ11ABCC8KCNJ8 | |
| SCHEMBL30266543 | 0.88 | ALDH1A1 (0.39) | ALDH1A1ABCC9KCNJ11ABCC8KCNJ8 | |
| SCHEMBL28969760 | 0.87 | ALDH1A1 (0.39) | ALDH1A1ABCC9KCNJ11ABCC8KCNJ8 | |
| SCHEMBL28969763 | 0.87 | ALDH1A1 (0.39) | ALDH1A1ABCC9KCNJ11ABCC8KCNJ8 | |
| SCHEMBL28969770 | 0.84 | ALDH1A1 (0.41) | ALDH1A1ABCC9KCNJ11ABCC8KCNJ8 | |
| SCHEMBL28969774 | 0.84 | ALDH1A1 (0.41) | ALDH1A1ABCC9KCNJ11ABCC8KCNJ8 | |
| SCHEMBL30266673 | 0.84 | ALDH1A1 (0.42) | ALDH1A1ABCC9KCNJ11ABCC8KCNJ8 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115836076-A | Methyl 2- (fluoromethyl) -5-oxo-4-phenyl-4,5,6,7-tetrahydro-1H-cyclopenta [ B ] pyridine-3-carboxylate and methyl 2- (fluoromethyl) -5-oxo-4-phenyl-1,4,5,7-tetrahydrofuro [3,4-B ] pyridine-3-carboxylate as CAV1.2 activators | 诺华股份有限公司 | 2023-03-21 | — | — | CN | claimed |
| CN-115836076-A | Methyl 2- (fluoromethyl) -5-oxo-4-phenyl-4,5,6,7-tetrahydro-1H-cyclopenta [ B ] pyridine-3-carboxylate and methyl 2- (fluoromethyl) -5-oxo-4-phenyl-1,4,5,7-tetrahydrofuro [3,4-B ] pyridine-3-carboxylate as CAV1.2 activators | 诺华股份有限公司 | 2023-03-21 | — | — | CN | disclosed |