Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.81 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.81 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.81 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.81 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.81 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.81 |
| ▸ | HTR2A | P28223 | 1/20 | 0.81 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.81 |
| ▸ | DRD3 | P35462 | 1/20 | 0.81 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.81 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.81 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.81 |
| ▸ | LMNA | P02545 | 4/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.46 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9227325 | 1.00 | KCNH2 (0.81) | KCNH2ADRA2CCACNA1FCHRM2ADRA2B | |
| SCHEMBL8198128 | 0.92 | KCNH2 (0.79) | KCNH2ADRA2CCACNA1FCHRM2ADRA2B | |
| SCHEMBL8198120 | 0.92 | KCNH2 (0.79) | KCNH2ADRA2CCACNA1FCHRM2ADRA2B | |
| SCHEMBL8198119 | 0.92 | KCNH2 (0.79) | KCNH2ADRA2CCACNA1FCHRM2ADRA2B | |
| SCHEMBL8196923 | 0.90 | KCNH2 (0.83) | KCNH2ADRA2CCACNA1FCHRM2ADRA2B | |
| SCHEMBL8196919 | 0.90 | KCNH2 (0.83) | KCNH2ADRA2CCACNA1FCHRM2ADRA2B | |
| SCHEMBL9218456 | 0.90 | KCNH2 (0.83) | KCNH2ADRA2CCACNA1FCHRM2ADRA2B | |
| Ibutilide SCHEMBL29761428 | 0.90 | KCNH2 (1.00) | KCNH2ADRA2CCACNA1FCHRM2ADRA2B | |
| Ibutilide SCHEMBL3719856 | 0.90 | KCNH2 (1.00) | KCNH2ADRA2CCACNA1FCHRM2ADRA2B | |
| SCHEMBL9625588 | 0.90 | KCNH2 (1.00) | KCNH2ADRA2CCACNA1FCHRM2ADRA2B |
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 |
|---|---|---|---|---|---|---|---|
| US-5405997-A | Stable against rapid metabolism | THE UPJOHN COMPANY (US) | 1995-04-11 | — | — | US | claimed |
| US-5405997-A | Stable against rapid metabolism | THE UPJOHN COMPANY (US) | 1995-04-11 | — | — | US | disclosed |