Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 2/20 | 0.49 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.42 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6953572 | 1.00 | ADRA2A (0.49) | ADRA2ACYP11B2CYP19A1CYP17A1HTR6 | |
| SCHEMBL8116582 | 1.00 | ADRA2A (0.49) | ADRA2ACYP11B2CYP19A1CYP17A1HTR6 | |
| SCHEMBL6955549 | 1.00 | ADRA2A (0.49) | ADRA2ACYP11B2CYP19A1CYP17A1HTR6 | |
| SCHEMBL8119984 | 1.00 | ADRA2A (0.49) | ADRA2ACYP11B2CYP19A1CYP17A1HTR6 | |
| Fumaric Acid SCHEMBL8092369 | 0.90 | ADRA2A (0.42) | ADRA2ACYP11B2CYP19A1CYP17A1 | |
| Fumaric Acid SCHEMBL8096772 | 0.90 | ADRA2A (0.42) | ADRA2ACYP11B2CYP19A1CYP17A1 | |
| Fumaric Acid SCHEMBL8097801 | 0.90 | ADRA2A (0.42) | ADRA2ACYP11B2CYP19A1CYP17A1 | |
| Fumaric Acid SCHEMBL8092366 | 0.90 | ADRA2A (0.42) | ADRA2ACYP11B2CYP19A1CYP17A1 | |
| Fumaric Acid SCHEMBL8096777 | 0.90 | ADRA2A (0.42) | ADRA2ACYP11B2CYP19A1CYP17A1 | |
| Fumaric Acid SCHEMBL8097796 | 0.90 | ADRA2A (0.42) | ADRA2ACYP11B2CYP19A1CYP17A1 |
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-1010693-B1 | Imidazoline derivatives, preparation and pharmaceutical compositions containing them | SERVIER LAB (FR) | 2003-09-24 | — | — | EP | disclosed |
| EP-1010693-A1 | Imidazoline derivatives, preparation and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 2000-06-21 | — | — | EP | disclosed |