Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9325409 | 0.94 | TDP1 (0.40) | LTA4HTDP1CYP3A4TSHRADRB2 | |
| SCHEMBL9324433 | 0.83 | SIGMAR1 (0.39) | CYP3A4TSHRADRB2HTR1AADRA2A | |
| SCHEMBL9326401 | 0.82 | NPC1 (0.48) | LTA4HHTR1AADRA2ACHRM1SLC6A2 | |
| SCHEMBL9326379 | 0.78 | KCNH2 (0.50) | KCNH2RAB9AMEN1MAPTKMT2A | |
| SCHEMBL9325440 | 0.77 | TAAR1 (0.43) | DRD2DRD3OPRK1 | |
| SCHEMBL9325624 | 0.76 | KCNH2 (0.48) | LTA4HCYP3A4ADRB2CYP2D6DRD3 | |
| SCHEMBL9325455 | 0.75 | HTR2A (0.39) | DRD2HTR2ADRD3KCNH2RAB9A | |
| SCHEMBL9325760 | 0.73 | CA12 (0.46) | CYP3A4CYP2D6ALDH1A1 | |
| SCHEMBL9327603 | 0.73 | LMNA (0.53) | CYP3A4TSHROPRK1KCNH2LMNA | |
| SCHEMBL9326153 | 0.69 | DRD2 (0.37) | DRD2HTR2ADRD3OPRK1KCNH2 |
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-5310941-A | Antiarrythmia agents | ORTHO PHARMACEUTICAL CORPORATION (US) | 1994-05-10 | — | — | US | disclosed |
| US-5208252-A | Antiarrhythmia | ORTHO PHARMACEUTICAL CORPORATION (US) | 1993-05-04 | — | — | US | disclosed |