Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.35 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | GPR3 | P46089 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | CETP | P11597 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9483528 | 1.00 | NR1H2 (0.35) | NR1H2NR1H3KCNH2PTPN1GPR3 | |
| SCHEMBL7572055 | 0.73 | GPR3 (0.35) | NR1H2NR1H3KCNH2PTPN1GPR3 | |
| SCHEMBL2405951 | 0.63 | TRPA1 (0.32) | — | |
| SCHEMBL10604576 | 0.63 | PTPN1 (0.57) | NR1H2NR1H3KCNH2PTPN1GPR3 | |
| SCHEMBL3259331 | 0.63 | ACHE (0.43) | KCNH2PTPN1TDP1GPR84MEN1 | |
| SCHEMBL5601077 | 0.62 | KCNH2 (0.39) | NR1H2NR1H3KCNH2PTPN1GPR3 | |
| SCHEMBL10606408 | 0.61 | PTPN1 (0.60) | NR1H2NR1H3KCNH2PTPN1GPR3 | |
| SCHEMBL3685991 | 0.61 | SETD7 (0.44) | NR1H2NR1H3KCNH2PTPN1GPR3 | |
| SCHEMBL5600758 | 0.61 | KCNH2 (0.42) | NR1H2NR1H3KCNH2PTPN1GPR3 | |
| SCHEMBL5601126 | 0.61 | KCNH2 (0.42) | NR1H2NR1H3KCNH2PTPN1GPR3 |
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-5268372-A | Where nitrogen in position 2 and 5 are connected by a methylene bridge | STERLING WINTHROP INC. (US) | 1993-12-07 | — | — | US | disclosed |
| US-5206231-A | 2,5-benzodiazocine antiarrhythmic agents | STERLING DRUG INC. (US) | 1993-04-27 | — | — | US | disclosed |