Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 4/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | THPO | P40225 | 1/20 | 0.53 |
| ▸ | BLM | P54132 | 1/20 | 0.53 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | RARB | P10826 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10359434 | 0.93 | RARB (0.55) | ALDH1A1NFKB1KDM4EMAPTL3MBTL1 | |
| SCHEMBL11114279 | 0.79 | ALDH1A1 (0.60) | ALDH1A1NFKB1KDM4EMAPTL3MBTL1 | |
| SCHEMBL9749021 | 0.79 | RARB (0.50) | ALDH1A1NFKB1KDM4EMAPTL3MBTL1 | |
| SCHEMBL9765769 | 0.77 | RARB (0.63) | ALDH1A1NFKB1KDM4EMAPTL3MBTL1 | |
| SCHEMBL9233439 | 0.77 | ALDH1A1 (0.62) | ALDH1A1NFKB1KDM4EMAPTL3MBTL1 | |
| SCHEMBL10826860 | 0.73 | SMN1; SMN2 (0.55) | ALDH1A1NFKB1MAPTMEN1LMNA | |
| SCHEMBL9852820 | 0.73 | KMT2A (0.40) | ALDH1A1MAPTMEN1LMNACYP1A2 | |
| SCHEMBL9564119 | 0.72 | RARB (0.43) | ALDH1A1NFKB1KDM4EMAPTL3MBTL1 | |
| SCHEMBL10335865 | 0.71 | RARB (0.60) | ALDH1A1NFKB1KDM4EMAPTL3MBTL1 | |
| SCHEMBL13447547 | 0.71 | NFKB1 (0.51) | ALDH1A1NFKB1KDM4EMAPTL3MBTL1 |
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-0220297-B1 | NITROGEN-CONTAINING HETEROCYCLES | MERCK PATENT GmbH (DE) | 1991-12-11 | — | — | EP | disclosed |
| EP-0220297-A1 | NITROGEN-CONTAINING HETEROCYCLES. | MERCK PATENT GMBH (DE) | 1987-05-06 | — | — | EP | disclosed |
| WO-1986006373-A1 | NITROGEN-CONTAINING HETEROCYCLES | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1986-11-06 | — | — | WO | disclosed |