Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | DGAT1 | O75907 | 5/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 4/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.37 |
| ▸ | HTR2C | P28335 | 2/20 | 0.35 |
| ▸ | HTR2B | P41595 | 2/20 | 0.35 |
| ▸ | MELK | Q14680 | 1/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 4/20 | 0.34 |
| ▸ | ITGA2B | P08514 | 4/20 | 0.34 |
| ▸ | SOAT1 | P35610 | 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 | |
|---|---|---|---|---|
| SCHEMBL9053164 | 1.00 | ACHE (0.41) | ACHEDGAT1FFAR4MCHR1HTR2C | |
| SCHEMBL9056444 | 0.82 | HPGDS (0.41) | ACHEDGAT1FFAR4HTR2CHTR2B | |
| SCHEMBL9056435 | 0.82 | HPGDS (0.41) | ACHEDGAT1FFAR4HTR2CHTR2B | |
| Hydrochloric Acid SCHEMBL9057145 | 0.81 | HPGDS (0.40) | ACHEDGAT1FFAR4HTR2CHTR2B | |
| SCHEMBL9056822 | 0.81 | ACHE (0.40) | ACHEDGAT1FFAR4MCHR1HTR2C | |
| SCHEMBL9056833 | 0.81 | ACHE (0.40) | ACHEDGAT1FFAR4MCHR1HTR2C | |
| SCHEMBL9254028 | 0.77 | DGAT1 (0.45) | DGAT1ITGB3ITGA2B | |
| SCHEMBL9058092 | 0.77 | DGAT1 (0.41) | ACHEDGAT1FFAR4MCHR1HTR2C | |
| SCHEMBL9058103 | 0.77 | DGAT1 (0.41) | ACHEDGAT1FFAR4MCHR1HTR2C | |
| SCHEMBL9055358 | 0.70 | HPGDS (0.36) | ACHEDGAT1FFAR4ITGB3ITGA2B |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996004271-A1 | CONDENSED AZEPINE DERIVATIVES, DRUGS CONTAINING THESE COMPOUNDS AND METHODS FOR PREPARING THEM | DR. KARL THOMAE GMBH (DE) | 1996-02-15 | — | — | WO | disclosed |