Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL11427100 | 0.86 | PARP1 (0.41) | CYP3A4KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL11271602 | 0.82 | PARP1 (0.40) | KMT2AMEN1MAPTALDH1A1HPGD | |
| SCHEMBL11668348 | 0.74 | ALDH1A1 (0.39) | KMT2AMEN1SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL11221731 | 0.69 | ALOX15 (0.39) | CYP3A4KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL7289989 | 0.67 | MAOA (0.38) | TSHR | |
| SCHEMBL11229451 | 0.66 | ALDH1A1 (0.33) | CYP3A4KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL16931627 | 0.66 | MAPT (0.46) | CYP3A4CYP11B2CYP11B1MAPTSMN1; SMN2 | |
| SCHEMBL11219802 | 0.65 | MAPT (0.33) | CYP3A4KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL11674029 | 0.65 | HTT (0.42) | KMT2AMEN1MAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL11668352 | 0.65 | SIGMAR1 (0.40) | CYP3A4KMT2AMAPTALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-4223151-A | 4-(6,7-DIMETHOXY-1-METHYL-ISOCHROMAN-1-YL)PYRIDINE | AMERICAN HOME PRODUCTS CORPORATION (US) | 1980-09-16 | — | — | US | claimed |
| US-4351942-A | Isochromans | AMERICAN HOME PRODUCTS CORP. (US) | 1982-09-28 | — | — | US | disclosed |
| US-4223151-A | 4-(6,7-DIMETHOXY-1-METHYL-ISOCHROMAN-1-YL)PYRIDINE | AMERICAN HOME PRODUCTS CORPORATION (US) | 1980-09-16 | — | — | US | disclosed |