Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 6/20 | 0.60 |
| ▸ | CD274 | Q9NZQ7 | 6/20 | 0.60 |
| ▸ | SMO | Q99835 | 1/20 | 0.54 |
| ▸ | CCR3 | P51677 | 1/20 | 0.49 |
| ▸ | HPGDS | O60760 | 1/20 | 0.49 |
| ▸ | SLC6A12 | P48065 | 1/20 | 0.49 |
| ▸ | DRD4 | P21917 | 3/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL15615184 | 0.93 | SMO (0.64) | PDCD1CD274SMOHPGDSDRD4 | |
| SCHEMBL16811962 | 0.93 | DRD4 (0.51) | PDCD1CD274SMOHPGDSDRD4 | |
| SCHEMBL16811932 | 0.90 | SMO (0.64) | PDCD1CD274SMOHPGDSDRD4 | |
| SCHEMBL16812754 | 0.89 | HPGDS (0.49) | PDCD1CD274SMOHPGDSDRD4 | |
| SCHEMBL16811885 | 0.87 | SMO (0.72) | PDCD1CD274SMOSLC6A12DRD4 | |
| SCHEMBL16811814 | 0.86 | SMO (0.62) | PDCD1CD274SMOCCR3SLC6A12 | |
| SCHEMBL16811793 | 0.86 | SMO (0.73) | PDCD1CD274SMODRD4SIGMAR1 | |
| SCHEMBL18286500 | 0.86 | SMO (0.57) | PDCD1CD274SMODRD4POLB | |
| SCHEMBL15615182 | 0.85 | SMO (0.66) | PDCD1CD274SMOHPGDSDRD4 | |
| SCHEMBL16811967 | 0.85 | SMO (0.51) | PDCD1CD274SMOCCR3HPGDS |
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-2014043608-A2 | SMOOTHENED MODULATORS AND METHODS OF USE THEREOF | DUKE UNIVERSITY (US) | 2014-03-20 | — | — | WO | disclosed |