Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | CTSL | P07711 | 4/20 | 0.39 |
| ▸ | CTSS | P25774 | 4/20 | 0.39 |
| ▸ | CTSB | P07858 | 3/20 | 0.39 |
| ▸ | CTSK | P43235 | 2/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | AKT1 | P31749 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9735833 | 0.76 | CYP3A4 (0.38) | MAOBCYP3A4ALOX15CTSLCTSS | |
| SCHEMBL9735829 | 0.71 | ADAM10 (0.38) | CYP3A4ALOX15CTSLCTSSCTSB | |
| SCHEMBL27876084 | 0.71 | LMNA (0.54) | CTSLCTSSCTSBCTSKALDH1A1 | |
| SCHEMBL6952737 | 0.70 | KDM4E (0.46) | MAOBALDH1A1KDM4EGAAHPGD | |
| SCHEMBL9737152 | 0.70 | CYP3A4 (0.46) | MAOBCYP3A4ALOX15ABCB1ALDH1A1 | |
| SCHEMBL9216547 | 0.69 | CYP3A4 (0.58) | CYP3A4ALOX15ABCB1KDM4E | |
| SCHEMBL9216538 | 0.69 | CYP3A4 (0.58) | CYP3A4ALOX15ABCB1KDM4E | |
| SCHEMBL9216552 | 0.69 | CYP3A4 (0.58) | CYP3A4ALOX15ABCB1KDM4E | |
| SCHEMBL6954418 | 0.69 | MAOB (0.56) | MAOBALDH1A1KDM4EGAAHPGD | |
| SCHEMBL9214355 | 0.68 | CYP3A4 (0.54) | CYP3A4ALOX15ABCB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5130322-A | CHROMAN DERIVATIVES | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1992-07-14 | — | — | US | disclosed |
| EP-0415065-A1 | Chroman derivatives | MERCK PATENT GmbH (DE) | 1991-03-06 | — | — | EP | disclosed |