Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.33 |
| ▸ | F10 | P00742 | 6/20 | 0.33 |
| ▸ | F2 | P00734 | 2/20 | 0.33 |
| ▸ | HTR2A | P28223 | 3/20 | 0.32 |
| ▸ | HTR2C | P28335 | 3/20 | 0.32 |
| ▸ | HTR2B | P41595 | 3/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.32 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4722615 | 1.00 | ABL1 (0.39) | ABL1CYP11B2P2RX7CYP11B1CHRNB2 | |
| SCHEMBL4724414 | 0.93 | P2RX7 (0.35) | ABL1P2RX7F10F2 | |
| SCHEMBL4724420 | 0.93 | P2RX7 (0.35) | ABL1P2RX7F10F2 | |
| SCHEMBL4721854 | 0.91 | P2RX7 (0.37) | P2RX7F10F2 | |
| SCHEMBL4721851 | 0.91 | P2RX7 (0.37) | P2RX7F10F2 | |
| SCHEMBL4719240 | 0.88 | ABL1 (0.38) | ABL1CYP11B2P2RX7CYP11B1CHRNB2 | |
| SCHEMBL4719238 | 0.88 | ABL1 (0.38) | ABL1CYP11B2P2RX7CYP11B1CHRNB2 | |
| SCHEMBL4722192 | 0.87 | CYP11B2 (0.32) | CYP11B2CYP11B1 | |
| SCHEMBL4722194 | 0.87 | CYP11B2 (0.32) | CYP11B2CYP11B1 | |
| SCHEMBL4722193 | 0.87 | CYP11B2 (0.32) | CYP11B2CYP11B1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |