Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 5/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 3/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.37 |
| ▸ | MMP13 | P45452 | 2/20 | 0.37 |
| ▸ | SCN10A | Q9Y5Y9 | 3/20 | 0.36 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.36 |
| ▸ | JAK2 | O60674 | 2/20 | 0.35 |
| ▸ | JAK1 | P23458 | 2/20 | 0.35 |
| ▸ | METAP1 | P53582 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3751314 | 0.87 | MMP13 (0.37) | AAK1SCN9ACYP3A4HCRTR1HCRTR2 | |
| SCHEMBL3753926 | 0.83 | MMP13 (0.42) | AAK1MMP13GPR119JAK2JAK1 | |
| SCHEMBL3738226 | 0.81 | MGLL (0.39) | AAK1MMP13GPR119JAK2JAK1 | |
| SCHEMBL3736510 | 0.81 | MGLL (0.39) | AAK1MMP13GPR119JAK2JAK1 | |
| SCHEMBL3738694 | 0.81 | PREP (0.38) | AAK1HCRTR1HCRTR2MMP13GPR119 | |
| SCHEMBL3745735 | 0.81 | BCL2 (0.45) | CYP3A4 | |
| SCHEMBL3751575 | 0.80 | MMP13 (0.41) | AAK1MMP13JAK2JAK1 | |
| SCHEMBL3741700 | 0.79 | AAK1 (0.40) | AAK1MMP13 | |
| SCHEMBL3747163 | 0.79 | AAK1 (0.41) | AAK1SCN9AHCRTR1HCRTR2MMP13 | |
| SCHEMBL3742665 | 0.78 | KDM4D (0.36) | AAK1CYP3A4MMP13GPR119JAK2 |
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-2009037719-A1 | NOVEL COMPOUNDS AS DIPEPTIDYL PEPTIDASE IV (DPP IV) INHIBITORS | LUPIN LIMITED (IN) | 2009-03-26 | — | — | WO | disclosed |