Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 14/20 | 0.46 |
| ▸ | EGLN2 | Q96KS0 | 2/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | HTR3A | P46098 | 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 | |
|---|---|---|---|---|
| SCHEMBL14909053 | 0.83 | NOTUM (0.42) | NOTUMEGLN2KEAP1CYP19A1CYP1A2 | |
| SCHEMBL16039381 | 0.79 | HCRTR2 (0.43) | NOTUMEGLN2HCRTR2HCRTR1 | |
| SCHEMBL16031459 | 0.79 | NOTUM (0.40) | NOTUMEGLN2HCRTR2HCRTR1CYP19A1 | |
| SCHEMBL20912232 | 0.75 | ALDH1A1 (0.47) | NOTUM | |
| SCHEMBL16113420 | 0.73 | NOTUM (0.47) | NOTUMEGLN2HCRTR2HCRTR1KEAP1 | |
| SCHEMBL22642750 | 0.72 | NOTUM (0.50) | NOTUMEGLN2HCRTR2HCRTR1CYP1A2 | |
| SCHEMBL28361867 | 0.70 | NOTUM (0.44) | NOTUMEGLN2HCRTR2HCRTR1KEAP1 | |
| SCHEMBL21030734 | 0.70 | NOTUM (0.42) | NOTUMEGLN2HCRTR2HCRTR1CYP19A1 | |
| SCHEMBL5612789 | 0.69 | NOTUM (0.56) | NOTUMEGLN2KEAP1CYP19A1 | |
| SCHEMBL30046228 | 0.69 | NOTUM (0.56) | NOTUMEGLN2KEAP1CYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105209468-A | Substituted 7-azabicycles and their use as orexin receptor modulators | JANSSEN PHARMACEUTICA NV | 2015-12-30 | — | — | CN | disclosed |