Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 2/20 | 0.46 |
| ▸ | CCR5 | P51681 | 2/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16333435 | 0.87 | OPRD1 (0.54) | TACR1CCR5OPRK1OPRD1OPRM1 | |
| SCHEMBL17764953 | 0.81 | OPRK1 (0.59) | OPRK1OPRD1OPRM1ALDH1A1TP53 | |
| SCHEMBL17764954 | 0.81 | OPRK1 (0.59) | OPRK1OPRD1OPRM1ALDH1A1TP53 | |
| SCHEMBL8433573 | 0.80 | SIGMAR1 (0.47) | TACR1CCR5SIGMAR1OPRK1CYP2D6 | |
| SCHEMBL16333504 | 0.78 | TACR1 (0.46) | TACR1CCR5SIGMAR1OPRK1OPRD1 | |
| SCHEMBL8550877 | 0.78 | CCR5 (0.51) | CCR5SIGMAR1OPRK1OPRD1OPRM1 | |
| SCHEMBL9098158 | 0.76 | CCR5 (0.49) | CCR5SIGMAR1OPRK1OPRD1OPRM1 | |
| SCHEMBL7167793 | 0.75 | SIGMAR1 (0.52) | TACR1CCR5SIGMAR1OPRK1SMN1; SMN2 | |
| SCHEMBL9097115 | 0.75 | CCR5 (0.48) | CCR5SIGMAR1OPRK1OPRD1OPRM1 | |
| SCHEMBL8476568 | 0.74 | CCR5 (0.43) | TACR1CCR5SIGMAR1OPRK1OPRD1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3013812-A2 | KAPPA OPIOID AGONISTS AND USES THEREOF | Nektar Therapeutics (US) | 2016-05-04 | — | — | EP | disclosed |
| WO-2014210436-A2 | KAPPA OPIOID AGONISTS AND USES THEREOF | NEKTAR THERAPEUTICS (US) | 2014-12-31 | — | — | WO | disclosed |