Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | TNF | P01375 | 1/20 | 0.39 |
| ▸ | GRM8 | O00222 | 1/20 | 0.39 |
| ▸ | GRM6 | O15303 | 1/20 | 0.39 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14698374 | 0.84 | MIF (0.37) | CYP1A2CYP2D6CYP2C19LMNAMAPT | |
| SCHEMBL14698215 | 0.84 | MIF (0.37) | CYP1A2CYP2D6CYP2C19LMNAMAPT | |
| SCHEMBL5720903 | 0.84 | ACHE (0.39) | CYP2D6CYP2C19L3MBTL1FFAR1OPRD1 | |
| SCHEMBL2294181 | 0.84 | CYP1A2 (0.54) | CYP1A2CYP2D6CYP2C19NPSR1L3MBTL1 | |
| SCHEMBL469053 | 0.83 | CTSS (0.42) | L3MBTL1CA2MAPTALDH1A1HSD17B10 | |
| Hydrochloric Acid SCHEMBL8323812 | 0.83 | CYP1A2 (0.53) | CYP1A2CYP2D6CYP2C19NPSR1L3MBTL1 | |
| SCHEMBL1573827 | 0.83 | CTSS (0.42) | L3MBTL1CA2MAPTALDH1A1HSD17B10 | |
| SCHEMBL1952090 | 0.83 | CTSS (0.42) | L3MBTL1CA2MAPTALDH1A1HSD17B10 | |
| Hydrochloric Acid SCHEMBL6692761 | 0.83 | CYP1A2 (0.53) | CYP1A2CYP2D6CYP2C19NPSR1L3MBTL1 | |
| SCHEMBL28393121 | 0.82 | DPP4 (0.50) | CYP2C19CA1CA2MAPTALDH1A1 |
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-0918059-B1 | Substituted imidazoline derivatives, their preparation, their use, and pharmaceutical compositions containing them | AVENTIS PHARMA GMBH (DE) | 2003-06-25 | — | — | EP | disclosed |
| EP-0918059-A1 | Substituted imidazoline derivatives, their preparation, their use, and pharmaceutical compositions containing them | Hoechst Marion Roussel Deutschland GmbH (DE) | 1999-05-26 | — | — | EP | disclosed |