Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 5/20 | 0.54 |
| ▸ | OPRL1 | P41146 | 5/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8605980 | 0.95 | OPRM1 (0.59) | OPRM1OPRL1SLC6A4SLC6A3SLC6A2 | |
| Hydrochloric Acid SCHEMBL5308781 | 0.94 | OPRM1 (0.57) | OPRM1OPRL1SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL9765023 | 0.80 | OPRM1 (0.72) | OPRM1OPRL1SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL8608551 | 0.79 | SLC6A4 (0.50) | OPRM1OPRL1SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL16887915 | 0.79 | OPRM1 (0.70) | OPRM1OPRL1SLC6A4SLC6A3SLC6A2 | |
| Hydrochloric Acid SCHEMBL5310523 | 0.78 | CYP3A4 (0.51) | OPRM1OPRL1SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL16887903 | 0.77 | OPRM1 (0.49) | OPRM1OPRL1SLC6A4SLC6A3SLC6A2 | |
| Maleic Acid SCHEMBL10899989 | 0.74 | OPRM1 (0.39) | OPRM1OPRL1CHRM2LMNACYP3A4 | |
| Hydrochloric Acid SCHEMBL5310699 | 0.74 | CYP3A4 (0.54) | OPRM1OPRL1SLC6A4SLC6A3SLC6A2 | |
| Hydrochloric Acid SCHEMBL2288 | 0.73 | SLC6A3 (0.45) | OPRM1OPRL1SLC6A4SLC6A3SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007041677-A9 | SOFT TISSUE IMPLANTS AND DRUG COMBINATION COMPOSITIONS, AND USE THEREOF | COMBINATORX INC (US) | 2007-05-31 | — | — | WO | disclosed |
| WO-2007041677-A2 | SOFT TISSUE IMPLANTS AND DRUG COMBINATION COMPOSITIONS, AND USE THEREOF | COMBINATORX, INCORPORATED (US) | 2007-04-12 | — | — | WO | disclosed |