Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IL1B | P01584 | 3/20 | 0.41 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.41 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | HRH2 | P25021 | 1/20 | 0.38 |
| ▸ | HTR1D | P28221 | 1/20 | 0.38 |
| ▸ | HTR1B | P28222 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL24182162 | 0.83 | IL1B (0.41) | IL1BP2RX7APPHTR1AADRA2A | |
| SCHEMBL22450851 | 0.78 | IL1B (0.49) | IL1BP2RX7APPHTR1AADRA2A | |
| SCHEMBL24067468 | 0.77 | IL1B (0.47) | IL1BP2RX7APPHTR1AADRA2A | |
| SCHEMBL24067308 | 0.74 | IL1B (0.45) | IL1BP2RX7APPHTR1AADRA2A | |
| SCHEMBL12303255 | 0.71 | APP (0.42) | IL1BP2RX7APPHTR1AADRA2A | |
| SCHEMBL2452131 | 0.69 | APP (0.41) | IL1BP2RX7APPHTR1AADRA2A | |
| SCHEMBL12167426 | 0.69 | APP (0.41) | IL1BP2RX7APPHTR1AADRA2A | |
| SCHEMBL22450723 | 0.69 | IL1B (0.51) | IL1BP2RX7APPHTR1AADRA2A | |
| SCHEMBL14515074 | 0.67 | IL1B (0.41) | IL1BP2RX7APPHTR1AADRA2A | |
| SCHEMBL12303250 | 0.67 | APP (0.42) | IL1BP2RX7APPHTR1AADRA2A |
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-3712162-A1 | SMAC MIMETICS USED AS IAP INHIBITORS AND USE THEREOF | Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) | 2020-09-23 | — | — | EP | disclosed |