Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 3/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | MET | P08581 | 1/20 | 0.37 |
| ▸ | NAMPT | P43490 | 4/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | CKS1B | P61024 | 1/20 | 0.36 |
| ▸ | SKP1 | P63208 | 1/20 | 0.36 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.36 |
| ▸ | CCR5 | P51681 | 1/20 | 0.36 |
| ▸ | MAP2K1 | Q02750 | 2/20 | 0.36 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2280478 | 0.89 | HTR6 (0.41) | HTR6CYP11B2MMP2MMP13BCHE | |
| SCHEMBL2224123 | 0.86 | HTR6 (0.44) | HTR6CYP11B2MMP2MMP13BCHE | |
| SCHEMBL2224973 | 0.83 | JAK1 (0.39) | HTR6OPRD1OPRK1 | |
| SCHEMBL2224673 | 0.81 | HTR6 (0.43) | HTR6OPRK1 | |
| SCHEMBL25693615 | 0.80 | HTR6 (0.45) | HTR6BCHEPIK3CACCR5ADAM17 | |
| SCHEMBL9953348 | 0.78 | HTR6 (0.47) | HTR6BCHEGPR119OPRD1PIK3CA | |
| SCHEMBL2224840 | 0.78 | HTR6 (0.49) | HTR6BCHEGPR119 | |
| SCHEMBL2225830 | 0.78 | HTR6 (0.43) | HTR6BCHEMAP2K1 | |
| SCHEMBL2225831 | 0.78 | HTR6 (0.43) | HTR6BCHEMAP2K1 | |
| SCHEMBL2276483 | 0.78 | HTR6 (0.48) | HTR6BCHEGPR119MET |
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-2523957-A1 | TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF | F. Hoffmann-La Roche AG (CH) | 2012-11-21 | — | — | EP | disclosed |
| WO-2011086053-A1 | TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF | F. HOFFMANN-LA ROCHE AG (CH) | 2011-07-21 | — | — | WO | disclosed |