Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 10/20 | 0.39 |
| ▸ | RAB9A | P51151 | 10/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 10/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.39 |
| ▸ | TP53 | P04637 | 5/20 | 0.39 |
| ▸ | POLB | P06746 | 4/20 | 0.39 |
| ▸ | PKM | P14618 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.38 |
| ▸ | HPGD | P15428 | 8/20 | 0.38 |
| ▸ | MAPT | P10636 | 7/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | CASP1 | P29466 | 2/20 | 0.38 |
| ▸ | PTPN7 | P35236 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 2/20 | 0.38 |
| ▸ | BLM | P54132 | 2/20 | 0.38 |
| ▸ | CASP7 | P55210 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3980455 | 0.87 | ALDH1A1 (0.48) | NPC1RAB9AHSD17B10SMN1; SMN2TP53 | |
| Isoxazole SCHEMBL27894024 | 0.72 | RAB9A (0.41) | PARP1NPC1RAB9AHSD17B10SMN1; SMN2 | |
| SCHEMBL28928829 | 0.71 | BRD4 (0.43) | NPC1RAB9AHSD17B10SMN1; SMN2TP53 | |
| SCHEMBL3263841 | 0.71 | RAB9A (0.63) | NPC1RAB9AHSD17B10SMN1; SMN2TP53 | |
| Isoxazole SCHEMBL28776356 | 0.70 | MEN1 (0.44) | PARP1ALDH1A1MEN1KMT2AHPGDS | |
| Isoxazole SCHEMBL28638568 | 0.68 | PARP1 (0.54) | PARP1 | |
| Isoxazole SCHEMBL2679369 | 0.67 | PARP1 (1.00) | PARP1 | |
| Isoxazole SCHEMBL1318 | 0.67 | — | — | |
| Isoxazole SCHEMBL393230 | 0.67 | — | — | |
| SCHEMBL19528998 | 0.66 | NOTUM (0.41) | NPC1RAB9AHSD17B10SMN1; SMN2TP53 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102762208-A | Pyrazolopyrimidines and related heterocycles as ck2 inhibitors | CYLENE PHARMACEUTICALS INC | 2012-10-31 | — | — | CN | disclosed |