Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPRA | P18433 | 1/20 | 0.55 |
| ▸ | FDPS | P14324 | 1/20 | 0.44 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.42 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.42 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.42 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.42 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.42 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.38 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.38 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7829954 | 0.79 | PTPRA (0.65) | PTPRAFDPSGRIN2DGRIN3BGRIN1 | |
| SCHEMBL7829956 | 0.79 | PTPRA (0.65) | PTPRAFDPSGRIN2DGRIN3BGRIN1 | |
| SCHEMBL9052552 | 0.75 | TAAR1 (0.41) | ADRA2AADRA2BADRA2CSMN1; SMN2TSHR | |
| SCHEMBL28201329 | 0.75 | KDM4E (0.39) | ADRA2AADRA2BADRA2CCSNK1A1TYRO3 | |
| SCHEMBL4060533 | 0.73 | TBXAS1 (0.39) | ADRA2AADRA2BADRA2CCYP1A2TSHR | |
| Bromide SCHEMBL28351579 | 0.72 | FPR2 (0.43) | ADRA2AADRA2BADRA2CKDM4E | |
| SCHEMBL9315687 | 0.72 | CPB2 (0.42) | ADRA2AADRA2BADRA2CCSNK1A1TYRO3 | |
| SCHEMBL1827060 | 0.72 | PTPRA (1.00) | PTPRAFDPSGRIN2DGRIN3BGRIN1 | |
| SCHEMBL2684214 | 0.72 | PTPRA (1.00) | PTPRAFDPSGRIN2DGRIN3BGRIN1 | |
| SCHEMBL12238431 | 0.72 | PTPRA (1.00) | PTPRAFDPSGRIN2DGRIN3BGRIN1 |
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-5652257-A | ANTICARCINOGENIC | MERCK & CO., INC. (US) | 1997-07-29 | — | — | US | disclosed |
| EP-0783517-A2 | THIOL-FREE INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | MERCK & CO. INC. (US) | 1997-07-16 | — | — | EP | disclosed |
| WO-1996010034-A2 | THIOL-FREE INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 1996-04-04 | — | — | WO | disclosed |