Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | JAK1 | P23458 | 1/20 | 0.36 |
| ▸ | JAK3 | P52333 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | SMO | Q99835 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL4603052 | 0.80 | DGAT2 (0.38) | CYP2D6DPP4GRIN2BHSD17B10HPGD | |
| SCHEMBL4605631 | 0.80 | PRMT3 (0.43) | CYP2D6DPP4 | |
| SCHEMBL4606161 | 0.69 | ALDH1A1 (0.41) | CYP2D6DPP4ALDH1A1HSD17B10HPGD | |
| SCHEMBL4605625 | 0.65 | PRMT3 (0.39) | CYP2D6DPP4SMN1; SMN2 | |
| SCHEMBL4603048 | 0.65 | KMT2A (0.42) | CYP2D6ALDH1A1HPGD | |
| SCHEMBL17144250 | 0.65 | CYP2D6 (0.46) | CYP2D6DPP4ALDH1A1LMNAHPGD | |
| SCHEMBL13313010 | 0.62 | SMN1; SMN2 (0.57) | ALDH1A1LMNAHPGDNPC1RAB9A | |
| SCHEMBL2646670 | 0.61 | DPP4 (0.50) | CYP2D6DPP4ALDH1A1LMNAHPGD | |
| SCHEMBL28509553 | 0.61 | ALDH1A1 (0.67) | ALDH1A1HSD17B10LMNAHPGDNPC1 | |
| SCHEMBL10677073 | 0.60 | IDO1 (0.35) | GRIN2B |
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 |
|---|---|---|---|---|---|---|---|
| EP-1917001-A2 | PHARMACEUTICAL COMPOSITION COMPRISING A DPP-IV INHIBITOR | F.HOFFMANN-LA ROCHE AG (CH) | 2008-05-07 | — | — | EP | disclosed |
| WO-2007017423-A2 | PHARMACEUTICAL COMPOSITION COMPRISING A DPP-IV INHIBITOR | F. HOFFMANN-LA ROCHE AG (CH) | 2007-02-15 | — | — | WO | disclosed |