Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | KRAS | P01116 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | APP | P05067 | 3/20 | 0.34 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.32 |
| ▸ | SNCA | P37840 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HTR6 | P50406 | 1/20 | 0.30 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.30 |
| ▸ | GCGR | P47871 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Ethoxycarbonyl Group SCHEMBL27474221 | 0.76 | MCL1 (0.42) | NOTUMKRAS | |
| Ethoxycarbonyl Group SCHEMBL27552398 | 0.76 | KMO (0.43) | APPNPY5RSNCALMNA | |
| Ethoxycarbonyl Group SCHEMBL28746661 | 0.76 | HTR2A (0.44) | KRASAPPNPY5RHTR6 | |
| Ethoxycarbonyl Group SCHEMBL27474750 | 0.74 | CNR1 (0.48) | NOTUMALDH1A1LMNA | |
| Ethoxycarbonyl Group SCHEMBL27552408 | 0.71 | HTR7 (0.41) | HTR6 | |
| Ethoxycarbonyl Group SCHEMBL27552397 | 0.71 | MTNR1A (0.31) | — | |
| Ethoxycarbonyl Group SCHEMBL28294128 | 0.71 | HTR2A (0.44) | KRASAR | |
| SCHEMBL13311382 | 0.70 | NOTUM (0.50) | NOTUMKRASNPY5RHTR6CYP1A2 | |
| Ethoxycarbonyl Group SCHEMBL27860365 | 0.69 | ALDH1A1 (0.41) | MEN1KMT2APOLBTDP1MAPT | |
| 1,2-Dichlorobenzene SCHEMBL27256387 | 0.68 | LMNA (0.43) | MEN1KMT2APOLBTDP1MAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100418968-C | Pirazino(aza)indole derivatives | VERNALIS RES LTD (GB) | 2008-09-17 | — | — | CN | disclosed |
| CN-1289499-C | Pyrazino (aza) indole derivatives | VERNALIS RES LTD (GB) | 2006-12-13 | — | — | CN | disclosed |
| CN-1837207-A | Pirazino(aza)indole derivatives | VERNALIS RES LTD (GB) | 2006-09-27 | — | — | CN | disclosed |
| CN-1337963-A | Pyrazino (aza) indole derivatives | VERNALIS RES LTD (GB) | 2002-02-27 | — | — | CN | disclosed |