Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CETP | P11597 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 4/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.36 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 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 | |
|---|---|---|---|---|
| SCHEMBL13060671 | 0.89 | OPRK1 (0.39) | SLC6A2SLC6A4SLC6A3OPRK1ADRA2B | |
| SCHEMBL13005484 | 0.86 | OPRK1 (0.47) | CETPSLC6A2SLC6A4SLC6A3OPRK1 | |
| SCHEMBL13005495 | 0.85 | OPRK1 (0.43) | CETPSLC6A2SLC6A4SLC6A3OPRK1 | |
| SCHEMBL13005492 | 0.82 | TSHR (0.42) | CETPSLC6A2SLC6A4SLC6A3OPRK1 | |
| SCHEMBL13005494 | 0.81 | ALOX5 (0.41) | CETPGRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL13005518 | 0.78 | CETP (0.40) | CETPSLC6A2SLC6A4SLC6A3OPRK1 | |
| SCHEMBL13005557 | 0.76 | SIGMAR1 (0.41) | CETPSLC6A2SLC6A4SLC6A3OPRK1 | |
| SCHEMBL13005605 | 0.76 | SLC6A2 (0.45) | CETPSLC6A2SLC6A4SLC6A3OPRK1 | |
| SCHEMBL16640979 | 0.76 | ALDH1A1 (0.50) | CETPSLC6A2SLC6A4SLC6A3OPRK1 | |
| SCHEMBL13005515 | 0.75 | CETP (0.40) | CETPSLC6A2SLC6A4SLC6A3OPRK1 |
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-7851637-B2 | Compounds and methods for inhibiting the interaction of BCL proteins with binding partners | INFINITY PHARMACEUTICALS, INC. (US) | 2010-12-14 | — | — | US | disclosed |
| US-7851637-B2 | Compounds and methods for inhibiting the interaction of BCL proteins with binding partners | INFINITY PHARMACEUTICALS, INC. (US) | 2010-12-14 | — | — | US | disclosed |