Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.55 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.55 |
| ▸ | LTA4H | P09960 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | PLK1 | P53350 | 1/20 | 0.52 |
| ▸ | FAAH | O00519 | 3/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | DRD2 | P14416 | 1/20 | 0.50 |
| ▸ | DRD4 | P21917 | 1/20 | 0.50 |
| ▸ | DRD3 | P35462 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL171915 | 0.98 | L3MBTL1 (0.60) | L3MBTL1CYP1A2CYP2D6CYP2C19TDP1 | |
| Methylamine SCHEMBL28028743 | 0.93 | CYP1A2 (0.56) | L3MBTL1CYP1A2CYP2D6CYP2C19TDP1 | |
| SCHEMBL4270834 | 0.88 | TSHR (0.64) | L3MBTL1CYP1A2CYP2D6CYP2C19TDP1 | |
| SCHEMBL8379631 | 0.88 | CYP1A2 (0.51) | L3MBTL1CYP1A2CYP2D6CYP2C19TDP1 | |
| 1,4-Dipropoxybenzene SCHEMBL122039 | 0.85 | LTA4H (0.67) | L3MBTL1CYP1A2CYP2D6CYP2C19LTA4H | |
| SCHEMBL5169009 | 0.84 | NR5A1 (0.62) | L3MBTL1CYP1A2CYP2D6CYP2C19TDP1 | |
| SCHEMBL9512559 | 0.83 | MCHR1 (0.51) | L3MBTL1CYP1A2CYP2D6CYP2C19TDP1 | |
| SCHEMBL8990702 | 0.83 | PTPN7 (0.54) | L3MBTL1CYP1A2CYP2D6CYP2C19TDP1 | |
| SCHEMBL13808346 | 0.83 | LTA4H (0.64) | L3MBTL1CYP1A2CYP2D6CYP2C19LTA4H | |
| SCHEMBL9114592 | 0.83 | CYP1A2 (0.63) | L3MBTL1CYP1A2CYP2D6CYP2C19TDP1 |
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-5672588-A | Purine derivatives | NOVO NORDISK A/S (DK) | 1997-09-30 | — | — | US | disclosed |
| EP-0603348-A1 | PURINE DERIVATIVES | NOVO NORDISK A/S (DK) | 1994-06-29 | — | — | EP | disclosed |
| WO-1993023418-A1 | PURINE DERIVATIVES | NOVO NORDISK A/S (DK) | 1993-11-25 | — | — | WO | disclosed |