Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | GABRP | O00591 | 2/20 | 0.43 |
| ▸ | GABRD | O14764 | 2/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.43 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.43 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.43 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.43 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.43 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.43 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.43 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.43 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.43 |
| ▸ | GABRE | P78334 | 2/20 | 0.43 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.43 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.43 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.43 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.43 |
| ▸ | DPP4 | P27487 | 2/20 | 0.42 |
| ▸ | DPP9 | Q86TI2 | 2/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12410076 | 0.81 | CYP1A2 (0.60) | CYP1A2GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL15314151 | 0.81 | CYP1A2 (0.60) | CYP1A2GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL13575653 | 0.78 | DPP4 (0.41) | CYP1A2GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL19143419 | 0.77 | LMNA (0.42) | CYP1A2DPP4DPP9KDM2AHPGD | |
| SCHEMBL14465421 | 0.76 | HPGD (0.36) | DPP4HPGD | |
| SCHEMBL23018627 | 0.74 | HPGD (0.35) | DPP4HPGD | |
| Trimethylammonium SCHEMBL27795883 | 0.74 | CYP1A2 (0.86) | CYP1A2GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL19569730 | 0.72 | CHRM1 (0.37) | CYP1A2HDAC1HDAC2HPGD | |
| SCHEMBL21228618 | 0.72 | CYP1A2 (0.54) | CYP1A2GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL16399077 | 0.72 | CYP1A2 (0.39) | CYP1A2GABRPGABRDGABRA1GABRB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2252144-B1 | USE OF ESTER AMIDES AS SOLVENTS, ESTER AMIDES AS SUCH, AND METHOD FOR PREPARING ESTER AMIDES | RHODIA OPERATIONS (FR) | 2023-08-02 | — | — | EP | disclosed |