Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 3/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.37 |
| ▸ | OGFRL1 | Q5TC84 | 3/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.37 |
| ▸ | PARP1 | P09874 | 7/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 4/20 | 0.35 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.34 |
| ▸ | HTR3A | P46098 | 2/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7257222 | 0.86 | CCNE2 (0.39) | OPRM1OPRD1OPRK1OGFRL1PIK3CA | |
| SCHEMBL7257414 | 0.85 | KCNH2 (0.39) | PARP1KCNH2GRM2HTR3A | |
| SCHEMBL7257413 | 0.85 | PARP1 (0.36) | PIK3CAPARP1KCNH2GRM2HTR3A | |
| SCHEMBL6508880 | 0.84 | CCR4 (0.39) | OPRM1OPRD1OPRK1OGFRL1PARP1 | |
| SCHEMBL6633308 | 0.84 | HRH1 (0.43) | PARP1KCNH2GRM2PTPN11HTR3A | |
| SCHEMBL7257145 | 0.82 | KCNH2 (0.37) | PARP1KCNH2GRM2HTR3AACHE | |
| SCHEMBL6630805 | 0.82 | PARP1 (0.43) | PARP1HTR3A | |
| SCHEMBL6631361 | 0.82 | HDAC6 (0.46) | PARP1KCNH2GRM2 | |
| SCHEMBL7262852 | 0.82 | MAPK1 (0.33) | PARP1KCNH2GRM2HTR3A | |
| Hydrochloric Acid SCHEMBL6510200 | 0.81 | PARP1 (0.42) | PARP1HTR3A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2003104233-A1 | 4,5-DIHYDRO-IMIDAZO (4,5,1-IJ) QUINOLIN-6-ONES DERIVATIVES AND THEIR USE AS POLY (ADP-RIBOSYL) TRANSFERASE (PARP) INHIBITORS | ALTANA PHARMA AG (DE) | 2003-12-18 | — | — | WO | disclosed |