Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPRA | P18433 | 1/20 | 0.50 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.47 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.47 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.47 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.47 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.47 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | FDPS | P14324 | 1/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27418349 | 1.00 | PTPRA (0.50) | PTPRAGRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL9491676 | 0.82 | KDM4E (0.63) | PTPRAGRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL22728750 | 0.82 | KDM4E (0.63) | PTPRAGRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL5949434 | 0.82 | GRIN2D (0.47) | PTPRAGRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL8913586 | 0.82 | GRIN2D (0.69) | PTPRAGRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL2255590 | 0.79 | SLC2A1 (0.40) | CYP1A2CYP2C19ADRB2ADRB1ADRB3 | |
| SCHEMBL29067189 | 0.79 | GRIN2D (0.45) | PTPRAGRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL8914138 | 0.79 | PTPRA (0.50) | PTPRAGRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL9494412 | 0.78 | PTPRA (0.54) | PTPRAGRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL9701276 | 0.77 | LMNA (0.56) | CYP1A2CYP2C19LMNAADRB2ADRB1 |
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-5606073-A | INTERMEDIATES FOR ADENOSINE ANTAGONISTS | EISAI CO., LTD. (JP) | 1997-02-25 | — | — | US | disclosed |
| US-5541213-A | ADENOSINE A1 RECEPTOR ANTAGONISTS, TREATMENT OF KIDNEY DISORDERS | EISAI CO., LTD. (JP) | 1996-07-30 | — | — | US | disclosed |
| EP-0630894-A1 | Propenoic acid derivatives as adenosine A1 antagonists | Eisai Co., Ltd. (JP) | 1994-12-28 | — | — | EP | disclosed |