Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 11/20 | 0.55 |
| ▸ | OPRD1 | P41143 | 10/20 | 0.55 |
| ▸ | HTR2A | P28223 | 2/20 | 0.50 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.50 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.49 |
| ▸ | HRH1 | P35367 | 1/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6692584 | 1.00 | OPRK1 (0.55) | OPRK1OPRD1HTR2AADRA2BADRA2C | |
| SCHEMBL6274651 | 1.00 | OPRK1 (0.55) | OPRK1OPRD1HTR2AADRA2BADRA2C | |
| SCHEMBL11783725 | 0.98 | OPRK1 (0.54) | OPRK1OPRD1HTR2AADRA2BADRA2C | |
| Acetic Acid SCHEMBL6276580 | 0.89 | OPRD1 (0.52) | OPRK1OPRD1OPRM1ALDH1A1 | |
| SCHEMBL13006631 | 0.82 | OPRK1 (0.46) | OPRK1OPRD1HTR2AADRA2BADRA2C | |
| SCHEMBL13453034 | 0.81 | OPRK1 (0.52) | OPRK1OPRD1HTR2AADRA2BADRA2C | |
| SCHEMBL13453338 | 0.81 | OPRK1 (0.52) | OPRK1OPRD1HTR2AADRA2BADRA2C | |
| SCHEMBL9915838 | 0.81 | OPRK1 (0.52) | OPRK1OPRD1HTR2AADRA2BADRA2C | |
| SCHEMBL5383411 | 0.79 | TRPA1 (0.53) | OPRK1OPRD1HTR2AADRA2BADRA2C | |
| SCHEMBL7322626 | 0.79 | TRPA1 (0.53) | OPRK1OPRD1HTR2AADRA2BADRA2C |
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 |
|---|---|---|---|---|---|---|---|
| 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 |