Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | ITK | Q08881 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | ICMT | O60725 | 5/20 | 0.35 |
| ▸ | PARP1 | P09874 | 5/20 | 0.35 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.34 |
| ▸ | 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 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30733160 | 0.86 | MPO (0.40) | GAANPSR1ALDH1A1PARP1 | |
| SCHEMBL8992541 | 0.85 | GRIN2D (0.47) | GAAKDM4EALDH1A1GRIN2DGRIN3B | |
| SCHEMBL11218056 | 0.84 | GRIN2D (0.33) | GRIN2DGRIN3BGRIN1GRIN2AGRIN2B | |
| SCHEMBL688424 | 0.80 | MTNR1A (0.39) | GAAKDM4EALDH1A1PARP1 | |
| SCHEMBL1252530 | 0.80 | PKM (0.34) | GAANPSR1PARP1 | |
| SCHEMBL30829735 | 0.79 | PARP1 (0.36) | GAAKDM4EALDH1A1PARP1 | |
| SCHEMBL656754 | 0.79 | PARP1 (0.36) | GAAKDM4EALDH1A1PARP1 | |
| SCHEMBL11500267 | 0.79 | GRIN2D (0.31) | GRIN2DGRIN3BGRIN1GRIN2AGRIN2B | |
| SCHEMBL9736522 | 0.78 | PKM (0.50) | GAAKDM4EALDH1A1CA2 | |
| SCHEMBL284553 | 0.78 | GABRA1 (0.39) | GAAKDM4EALDH1A1 |
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-2635275-A1 | GPR17-MODULATING COMPOUNDS, DIAGNOSTIC AND THERAPEUTIC USES THEREOF | Centro Cardiologico Monzino SpA (IT) | 2013-09-11 | — | — | EP | disclosed |
| WO-2012059869-A1 | GPR17-MODULATING COMPOUNDS, DIAGNOSTIC AND THERAPEUTIC USES THEREOF | UNIVERSITA' DEGLI STUDI DI MILANO (IT) | 2012-05-10 | — | — | WO | disclosed |