Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 8/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.34 |
| ▸ | GRN | P28799 | 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 | |
|---|---|---|---|---|
| SCHEMBL5069850 | 0.83 | KCNH2 (0.40) | P2RX7KCNH2CHRM1CHRM3TP53 | |
| SCHEMBL5072494 | 0.78 | KCNH2 (0.41) | P2RX7KCNH2CHRM1CHRM3TP53 | |
| SCHEMBL5069595 | 0.77 | KCNH2 (0.46) | P2RX7KCNH2TP53MCHR1CYP2D6 | |
| SCHEMBL5069602 | 0.75 | KCNH2 (0.39) | P2RX7KCNH2CHRM1CHRM3TP53 | |
| SCHEMBL5072475 | 0.75 | KCNH2 (0.37) | P2RX7KCNH2LMNAMAPTCHRM1 | |
| SCHEMBL5072499 | 0.71 | P2RX7 (0.41) | P2RX7KCNH2CYP2D6GRNSORT1 | |
| SCHEMBL5069860 | 0.67 | KCNH2 (0.41) | P2RX7KCNH2CYP2D6 | |
| SCHEMBL5067713 | 0.67 | KCNH2 (0.47) | P2RX7KCNH2CHRM1CHRM3TP53 | |
| SCHEMBL2886995 | 0.66 | KCNH2 (0.59) | KCNH2CYP2D6NPC1RAB9ATAAR1 | |
| SCHEMBL5334839 | 0.65 | HPGD (0.68) | LMNAMAPTTP53KDM4EMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1901746-A2 | 4-FLUORO-PIPERIDINE T-TYPE CALCIUM CHANNEL ANTAGONISTS | Merck & Co., Inc. (US) | 2008-03-26 | — | — | EP | claimed |
| WO-2007002884-A2 | 4-FLUORO-PIPERIDINE T-TYPE CALCIUM CHANNEL ANTAGONISTS | MERCK & CO., INC. (US) | 2007-01-04 | — | — | WO | claimed |