Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 2/20 | 0.50 |
| ▸ | DRD2 | P14416 | 2/20 | 0.49 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.45 |
| ▸ | GRM2 | Q14416 | 3/20 | 0.43 |
| ▸ | USP5 | P45974 | 1/20 | 0.43 |
| ▸ | RBP4 | P02753 | 1/20 | 0.41 |
| ▸ | CCR2 | P41597 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1761033 | 0.82 | DRD2 (0.56) | HTR2CDRD2CHRM4GRM2USP5 | |
| SCHEMBL8619066 | 0.77 | DRD2 (0.44) | HTR2CDRD2CHRM4GRM2USP5 | |
| SCHEMBL1581482 | 0.75 | DRD2 (0.58) | HTR2CDRD2CHRM4GRM2USP5 | |
| SCHEMBL4813515 | 0.73 | CHRM4 (0.58) | HTR2CDRD2CHRM4GRM2USP5 | |
| SCHEMBL22816107 | 0.73 | HTR2C (0.66) | HTR2CDRD2GRM2USP5DRD4 | |
| SCHEMBL31154443 | 0.72 | AKR1C3 (0.62) | HTR2CDRD2GRM2USP5CCR2 | |
| SCHEMBL31154407 | 0.72 | AKR1C3 (0.62) | HTR2CDRD2GRM2USP5CCR2 | |
| SCHEMBL25090261 | 0.72 | HTR2C (0.58) | HTR2CDRD2GRIN2BHTR1AHTR2B | |
| SCHEMBL25090545 | 0.72 | HTR2C (0.58) | HTR2CDRD2GRIN2BHTR1AHTR2B | |
| SCHEMBL25090547 | 0.72 | HTR2C (0.58) | HTR2CDRD2GRIN2BHTR1AHTR2B |
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 |
|---|---|---|---|---|---|---|---|
| CN-101448844-B | Thiazolo-pyramidine / pyridine urea derivatives as adenosine a2b receptor antagonists | HOFFMANN LA ROCHE | 2012-07-25 | — | — | CN | disclosed |
| CN-101448844-A | Thiazolo-pyramidine / pyridine urea derivatives as adenosine a2b receptor antagonists | HOFFMANN LA ROCHE (CH) | 2009-06-03 | — | — | CN | disclosed |