Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 3/20 | 0.47 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.47 |
| ▸ | HTR2C | P28335 | 3/20 | 0.42 |
| ▸ | HTR6 | P50406 | 2/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | KDM2B | Q8NHM5 | 3/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 2/20 | 0.36 |
| ▸ | TNF | P01375 | 1/20 | 0.36 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.36 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.36 |
| ▸ | MLNR | O43193 | 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 | |
|---|---|---|---|---|
| SCHEMBL12818556 | 0.98 | CYP11B1 (0.47) | CYP11B1CYP11B2HTR2CHTR6DRD2 | |
| SCHEMBL12818566 | 0.85 | CYP11B1 (0.35) | CYP11B1CYP11B2HTR2CHTR6DRD2 | |
| SCHEMBL12818649 | 0.83 | CYP11B1 (0.43) | CYP11B1CYP11B2HTR2CHTR6HTR2A | |
| SCHEMBL12818905 | 0.83 | CYP11B1 (0.35) | CYP11B1CYP11B2HTR2CHTR6DRD2 | |
| SCHEMBL1817915 | 0.81 | CCR6 (0.45) | CYP11B1CYP11B2 | |
| SCHEMBL12818247 | 0.81 | GAA (0.42) | CYP11B1CYP11B2KDM2BGAA | |
| SCHEMBL12818419 | 0.79 | HTR6 (0.40) | CYP11B1CYP11B2HTR2CHTR6DRD2 | |
| SCHEMBL12818513 | 0.79 | CYP11B1 (0.48) | CYP11B1CYP11B2HTR2CHTR6DRD2 | |
| SCHEMBL12818035 | 0.78 | CYP11B1 (0.47) | CYP11B1CYP11B2HTR2CHTR6DRD2 | |
| SCHEMBL12817726 | 0.78 | HSPD1 (0.38) | CYP11B1CYP11B2KDM2BGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012130306-A1 | BICYCLIC 2,3-DIHYRDOBENZAZINE COMPOUNDS FOR USE IN THERAPY | ELARA PHARMACEUTICALS GMBH (DE) | 2012-10-04 | — | — | WO | claimed |
| WO-2012130306-A1 | BICYCLIC 2,3-DIHYRDOBENZAZINE COMPOUNDS FOR USE IN THERAPY | ELARA PHARMACEUTICALS GMBH (DE) | 2012-10-04 | — | — | WO | disclosed |