Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.33 |
| ▸ | DPP7 | Q9UHL4 | 3/20 | 0.32 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.32 |
| ▸ | DPP9 | Q86TI2 | 2/20 | 0.32 |
| ▸ | RRM1 | P23921 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11533680 | 0.89 | CYP2C9 (0.37) | CYP2C9DPP7DPP8DPP9MEN1 | |
| SCHEMBL10967630 | 0.84 | GABRR1 (0.31) | GABRR1 | |
| SCHEMBL12826931 | 0.74 | CYP2C9 (0.43) | CYP2C9GABRR1DPP7DPP8DPP9 | |
| SCHEMBL23020318 | 0.72 | CA1 (0.50) | MEN1KMT2A | |
| SCHEMBL29775550 | 0.71 | SLC6A5 (0.46) | CYP2C9GABRR1 | |
| Maleic Acid SCHEMBL17185149 | 0.70 | MEN1 (0.36) | GABRR1MEN1KMT2A | |
| SCHEMBL10798898 | 0.69 | — | — | |
| SCHEMBL28198989 | 0.66 | DNM1 (0.57) | CYP2C9GABRR1DPP7DPP9MEN1 | |
| SCHEMBL11470746 | 0.65 | CYP2C9 (0.43) | CYP2C9MEN1KMT2A | |
| SCHEMBL11470745 | 0.65 | CYP2C9 (0.43) | CYP2C9MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0046712-B1 | FLUORINATED DIAMINOBUTANE DERIVATIVES | MERRELL TORAUDE ET COMPAGNIE (FR) | 1985-02-06 | — | — | EP | disclosed |
| US-4435425-A | INHIBITORS OF GAMMA-AMINOBUTYRIC ACID TRANSAMINASE | MERRELL TORAUDE ET COMPAGNIE (FR) | 1984-03-06 | — | — | US | disclosed |
| EP-0046712-A1 | Fluorinated diaminobutane derivatives | MERRELL TORAUDE ET COMPAGNIE (FR) | 1982-03-03 | — | — | EP | disclosed |