Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 5/20 | 0.47 |
| ▸ | CHRM5 | P08912 | 5/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9738757 | 0.82 | NPC1 (0.43) | PARP1CHRM5NPY5ROPRM1SIGMAR1 | |
| SCHEMBL9740223 | 0.82 | CHRM5 (0.48) | PARP1CHRM5CYP3A4TSHRNPC1 | |
| SCHEMBL9740491 | 0.80 | MEN1 (0.40) | CHRM5CYP1A2CYP3A4NPC1POLB | |
| SCHEMBL9738947 | 0.79 | HTT (0.42) | CHRM5NPY5ROPRM1OPRK1NPC1 | |
| SCHEMBL9742140 | 0.79 | CHRM5 (0.49) | PARP1CHRM5OPRM1OPRD1OPRK1 | |
| SCHEMBL9738938 | 0.78 | NPC1 (0.40) | PARP1CHRM5CYP1A2CYP3A4NPY5R | |
| SCHEMBL9738615 | 0.77 | CHRM5 (0.46) | CHRM5CYP1A2CYP3A4NPC1POLB | |
| SCHEMBL9739497 | 0.77 | MAPT (0.46) | PARP1CHRM5NPC1POLB | |
| SCHEMBL9739249 | 0.77 | SLC6A3 (0.40) | PARP1NPC1POLB | |
| SCHEMBL29795000 | 0.76 | LMNA (0.38) | CYP1A2CYP3A4TSHRNPC1 |
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-1992016529-A1 | NOVEL ISOINDOLE DERIVATIVES AND MEDICAMENTS CONTAINING THEM | BOEHRINGER MANNHEIM GMBH (DE) | 1992-10-01 | — | — | WO | disclosed |