Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.39 |
| ▸ | DRD5 | P21918 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL904323 | 0.85 | DRD2 (0.39) | DRD2DRD1DRD5DRD3 | |
| SCHEMBL904313 | 0.81 | DRD1 (0.39) | ALDH1A1KDM4EHPGDSMN1; SMN2DRD1 | |
| SCHEMBL904319 | 0.81 | NR1H2 (0.43) | SLC6A2SLC6A4SLC6A3ALDH1A1KDM4E | |
| SCHEMBL904310 | 0.74 | CA1 (0.53) | SLC6A2SLC6A4SLC6A3ALDH1A1KDM4E | |
| SCHEMBL9146594 | 0.72 | CYP19A1 (0.63) | SLC6A2SLC6A4SLC6A3ALDH1A1CYP19A1 | |
| SCHEMBL17697978 | 0.69 | DRD2 (0.56) | ALDH1A1KDM4EHPGDMAPTL3MBTL1 | |
| SCHEMBL1990706 | 0.69 | DRD1 (0.55) | ALDH1A1KDM4EHPGDMAPTL3MBTL1 | |
| SCHEMBL12601843 | 0.68 | KDM4E (0.47) | ALDH1A1KDM4EHPGDMAPTL3MBTL1 | |
| SCHEMBL1987539 | 0.67 | DRD2 (0.53) | ALDH1A1KDM4EHPGDMAPTL3MBTL1 | |
| SCHEMBL1986645 | 0.67 | KDM4E (0.49) | ALDH1A1KDM4EHPGDMAPTL3MBTL1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012041227-A1 | TETRACYCLIC HETEROCYCLE COMPOUNDS FOR TREATING HEPATITIS C VIRAL INFECTION | MERCK SHARP & DOHME CORP. (US) | 2012-04-05 | — | — | WO | disclosed |