Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPYD | Q12882 | 3/20 | 0.60 |
| ▸ | GDA | Q9Y2T3 | 2/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 5/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.33 |
| ▸ | UPP1 | Q16831 | 1/20 | 0.32 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL189451 | 0.75 | DPYD (1.00) | DPYDMCL1KDM4EALDH1A1HPGD | |
| SCHEMBL9008314 | 0.65 | GDA (0.71) | DPYDGDAACHEKDM4EALDH1A1 | |
| SCHEMBL3254445 | 0.65 | DYRK1A (0.52) | DPYDDYRK1AKDM4EALDH1A1IMPDH2 | |
| Uric Acid SCHEMBL27548112 | 0.64 | GDA (0.76) | DPYDGDAACHEKDM4EALDH1A1 | |
| SCHEMBL5048035 | 0.64 | PIM1 (0.40) | DPYDGDAACHEKDM4EALDH1A1 | |
| SCHEMBL187437 | 0.64 | DPYD (0.64) | DPYDMCL1KDM4EALDH1A1HPGD | |
| SCHEMBL3945500 | 0.63 | PNP (0.45) | DPYDALDH1A1 | |
| Uric Acid SCHEMBL28124016 | 0.63 | GDA (0.73) | DPYDGDAACHEKDM4EALDH1A1 | |
| Uric Acid SCHEMBL28323281 | 0.63 | GDA (0.73) | DPYDGDAACHEKDM4EALDH1A1 | |
| Uric Acid SCHEMBL27432318 | 0.63 | GDA (0.73) | DPYDGDAACHEKDM4EALDH1A1 |
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-1966215-A1 | CONDENSED HETEROCYCLIC COMPOUNDS USEFUL AS DPP-IV INHIBITORS | Novartis AG (CH) | 2008-09-10 | — | — | EP | disclosed |
| WO-2007071738-A1 | CONDENSED HETEROCYCLIC COMPOUNDS USEFUL AS DPP-IV INHIBITORS | NOVARTIS AG (CH) | 2007-06-28 | — | — | WO | disclosed |