Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | KDM6B | O15054 | 1/20 | 0.36 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.36 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | TLR8 | Q9NR97 | 3/20 | 0.34 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | RAF1 | P04049 | 1/20 | 0.33 |
| ▸ | ABCC1 | P33527 | 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 | |
|---|---|---|---|---|
| SCHEMBL8750751 | 0.83 | CHEK1 (0.42) | CYP11B1CYP11B2RAF1 | |
| SCHEMBL14155105 | 0.75 | TLR8 (0.47) | ABCB1ABCG2TLR8TLR7ALDH1A1 | |
| SCHEMBL1419851 | 0.75 | CHRNB2 (0.43) | CHRNB2CHRNA4POLBKDM6BKDM4C | |
| SCHEMBL8176730 | 0.74 | ABCB1 (0.52) | ABCB1ABCG2MGLLTLR8TLR7 | |
| SCHEMBL14007397 | 0.73 | ALDH1A1 (0.44) | CHRNB2CHRNA4CYP11B1CYP11B2KDM4E | |
| SCHEMBL8244430 | 0.73 | SCN10A (0.37) | CHRNB2CHRNA4CYP11B1CYP11B2RAF1 | |
| SCHEMBL7220029 | 0.71 | TSHR (0.44) | CHRNB2CHRNA4ALDH1A1HPGDRAF1 | |
| SCHEMBL28133362 | 0.71 | ABL1 (0.44) | ABCB1ABCG2TLR8TLR7ALDH1A1 | |
| SCHEMBL18386511 | 0.70 | ABL1 (0.43) | CHRNB2CHRNA4 | |
| SCHEMBL8237778 | 0.70 | KCNH2 (0.46) | POLBALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0634400-B1 | PYRIDINECARBOXIMIDAMIDE COMPOUND AND USE THEREOF | KIRIN BREWERY (JP) | 1997-04-02 | — | — | EP | disclosed |
| US-5508293-A | TREATING HYPERTENSION, ANGINA PECTORIS | KIRIN BEER KABUSHIKI KAISHA (JP) | 1996-04-16 | — | — | US | disclosed |
| EP-0634400-A1 | PYRIDINECARBOXIMIDAMIDE COMPOUND AND USE THEREOF | KIRIN BEER KABUSHIKI KAISHA (JP) | 1995-01-18 | — | — | EP | disclosed |