Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL6280169 | 0.86 | KDM4E (0.57) | SMN1; SMN2KDM4EALDH1A1MEN1GAA | |
| SCHEMBL6286175 | 0.86 | SMN1; SMN2 (0.70) | SMN1; SMN2KDM4EALDH1A1MEN1MAPK1 | |
| SCHEMBL6285402 | 0.85 | MAPT (0.56) | SMN1; SMN2KDM4EALDH1A1CYP1A2GAA | |
| SCHEMBL6276607 | 0.83 | ALDH1A1 (0.65) | SMN1; SMN2KDM4EALDH1A1MEN1CYP1A2 | |
| SCHEMBL6280738 | 0.81 | KDM4E (0.57) | SMN1; SMN2KDM4EALDH1A1CYP1A2GAA | |
| SCHEMBL6282785 | 0.78 | ALOX12 (0.66) | SMN1; SMN2KDM4EALDH1A1GAAMAPK1 | |
| SCHEMBL6281843 | 0.78 | SMN1; SMN2 (0.57) | SMN1; SMN2KDM4EALDH1A1MEN1GAA | |
| SCHEMBL4391482 | 0.78 | MAPK1 (0.70) | SMN1; SMN2KDM4EALDH1A1MEN1CYP1A2 | |
| SCHEMBL3424745 | 0.78 | PDE10A (0.62) | SMN1; SMN2KDM4EALDH1A1MEN1CYP1A2 | |
| SCHEMBL6279307 | 0.77 | KDM4E (0.56) | SMN1; SMN2KDM4EALDH1A1MEN1GAA |
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-6897213-B1 | Heterocycles as cholecystokinin (CCK) ligands | WARNER-LAMBERT COMPANY (US) | 2005-05-24 | — | — | US | disclosed |
| WO-1996020178-A1 | NOVEL HETEROCYCLES AS CHOLECYSTOKININ (CCK) LIGANDS | WARNER-LAMBERT COMPANY (US) | 1996-07-04 | — | — | WO | disclosed |