Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.57 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.40 |
| ▸ | HTR2A | P28223 | 3/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.36 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2079404 | 0.86 | ALOX15 (0.41) | SIGMAR1OPRM1TSHROPRL1OPRD1 | |
| SCHEMBL29710660 | 0.82 | ALOX15 (0.38) | SIGMAR1OPRM1TSHROPRL1OPRD1 | |
| SCHEMBL1703171 | 0.82 | ALOX15 (0.38) | SIGMAR1OPRM1TSHROPRL1OPRD1 | |
| SCHEMBL7102084 | 0.82 | ALOX15 (0.38) | SIGMAR1OPRM1TSHROPRL1OPRD1 | |
| SCHEMBL1660350 | 0.82 | SIGMAR1 (0.62) | SIGMAR1DRD2OPRM1HTR2ASLC6A2 | |
| SCHEMBL2270935 | 0.81 | SIGMAR1 (0.62) | SIGMAR1DRD2OPRM1HTR2COPRL1 | |
| Hydrochloric Acid SCHEMBL10007651 | 0.80 | SIGMAR1 (0.61) | SIGMAR1DRD2OPRM1HTR2ASLC6A2 | |
| SCHEMBL632646 | 0.80 | OPRM1 (0.37) | SIGMAR1OPRM1SLC6A2SLC6A4OPRL1 | |
| SCHEMBL7101793 | 0.80 | OPRM1 (0.37) | SIGMAR1OPRM1SLC6A2SLC6A4OPRL1 | |
| Hydrochloric Acid SCHEMBL8175707 | 0.79 | SIGMAR1 (0.60) | SIGMAR1DRD2OPRM1HTR2COPRL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008021375-A2 | MODULATORS OF MUSCARINIC RECEPTORS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-02-21 | — | — | WO | disclosed |