Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.34 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 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 | |
|---|---|---|---|---|
| SCHEMBL9738757 | 0.90 | NPC1 (0.43) | NPC1POLBPARP1SMN1; SMN2HTT | |
| SCHEMBL9740491 | 0.80 | MEN1 (0.40) | NPC1POLBSMN1; SMN2HTTMAPT | |
| SCHEMBL9739497 | 0.80 | MAPT (0.46) | NPC1POLBPARP1SMN1; SMN2HTT | |
| SCHEMBL9739249 | 0.80 | SLC6A3 (0.40) | NPC1POLBPARP1SMN1; SMN2HTT | |
| SCHEMBL9739723 | 0.79 | LMNA (0.46) | NPC1POLBPARP1SMN1; SMN2HTT | |
| SCHEMBL9738947 | 0.79 | HTT (0.42) | NPC1POLBSMN1; SMN2HTTLMNA | |
| SCHEMBL9739810 | 0.78 | PARP1 (0.47) | NPC1POLBPARP1NPY5RCYP1A2 | |
| SCHEMBL9739775 | 0.75 | NPC1 (0.38) | NPC1POLBSMN1; SMN2HTT | |
| SCHEMBL9739705 | 0.75 | MEN1 (0.37) | NPC1POLBPARP1SMN1; SMN2HTT | |
| SCHEMBL9739157 | 0.74 | PARP1 (0.39) | NPC1POLBPARP1SMN1; SMN2HTT |
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 |