Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 8/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | SELP | P16109 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.44 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 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 | |
|---|---|---|---|---|
| SCHEMBL13780575 | 0.95 | MAPT (0.47) | PTPN1MAPTKDM4ESELPADORA3 | |
| SCHEMBL13679695 | 0.94 | NOX1 (0.45) | PTPN1MAPTKDM4ESELPADORA3 | |
| SCHEMBL22579327 | 0.83 | MAPT (0.60) | MAPTKDM4EHTTALDH1A1SMN1; SMN2 | |
| SCHEMBL13679697 | 0.78 | ABCB1 (0.62) | PTPN1MAPTSELPSIRT2SIRT1 | |
| SCHEMBL13679655 | 0.76 | PTPN1 (0.46) | PTPN1MAPTKDM4EADORA3ADORA2B | |
| SCHEMBL32673048 | 0.76 | PTPN1 (0.52) | PTPN1MAPTKDM4ESELPADORA3 | |
| SCHEMBL13679678 | 0.75 | ABCB1 (0.63) | PTPN1MAPTKDM4ESELPSIRT2 | |
| SCHEMBL6611775 | 0.75 | PTPN1 (0.51) | PTPN1MAPTKDM4ESELPADORA3 | |
| SCHEMBL13780561 | 0.74 | NOX1 (0.62) | MAPTSIRT2SIRT1ALDH1A1PARP1 | |
| SCHEMBL13679672 | 0.73 | ABCB1 (0.56) | PTPN1MAPTKDM4ESELPHTT |
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-0999835-B1 | IMIDAZOLE DERIVATIVES AS MDR MODULATORS | TAIJI BIOMEDICAL INC (US) | 2009-09-09 | — | — | EP | disclosed |
| EP-2082740-A2 | Use of imidazole derivatives as MDR modulators | Taiji Biomedical, Inc. (US) | 2009-07-29 | — | — | EP | disclosed |