Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 9/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | PDE2A | O00408 | 2/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | AHR | P35869 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 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 | |
|---|---|---|---|---|
| SCHEMBL27844724 | 0.88 | PDE2A (0.49) | MCL1ALDH1A1L3MBTL1MEN1TSHR | |
| SCHEMBL16950457 | 0.78 | PDE2A (0.45) | MCL1ALDH1A1L3MBTL1MEN1TSHR | |
| SCHEMBL27857728 | 0.76 | HSD11B1 (0.38) | PDE2AHSD11B1AHRKIF11 | |
| SCHEMBL27844705 | 0.75 | ACP3 (0.42) | TSHRHSD11B1 | |
| SCHEMBL1508481 | 0.70 | PDE2A (0.50) | MCL1ALDH1A1L3MBTL1MEN1TSHR | |
| SCHEMBL22930904 | 0.69 | PDE2A (0.54) | MCL1KMT2APDE2AHSD11B1HTR2A | |
| SCHEMBL16954268 | 0.69 | PDE2A (0.54) | MCL1KMT2APDE2AHSD11B1HTR2A | |
| SCHEMBL3248499 | 0.69 | PDE2A (0.42) | MCL1ALDH1A1L3MBTL1MEN1TSHR | |
| SCHEMBL27643682 | 0.69 | PDE2A (0.50) | MCL1ALDH1A1L3MBTL1MEN1TSHR | |
| SCHEMBL12015778 | 0.69 | PDE2A (0.58) | MCL1TSHRKMT2APDE2AHSD11B1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102292319-A | Novel substituted octahydrocyclopenta(C)pyrrol-4-amines as calcium channel blockers | — | 2011-12-21 | — | — | CN | disclosed |