Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 11/20 | 0.39 |
| ▸ | AURKA | O14965 | 10/20 | 0.39 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NQO2 | P16083 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3046786 | 0.99 | KDR (0.38) | KDRAURKASLC2A1PKMSMN1; SMN2 | |
| SCHEMBL3048287 | 0.95 | AURKA (0.40) | KDRAURKASLC2A1PKMSMN1; SMN2 | |
| SCHEMBL3047838 | 0.91 | AURKA (0.40) | KDRAURKASLC2A1PKMSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL3034396 | 0.91 | AURKA (0.40) | KDRAURKASLC2A1PKMSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL3046374 | 0.90 | AURKA (0.37) | KDRAURKASLC2A1PKMSMN1; SMN2 | |
| SCHEMBL3049157 | 0.90 | AURKA (0.41) | KDRAURKAPKMSMN1; SMN2NQO2 | |
| Hydrochloric Acid SCHEMBL3042710 | 0.89 | AURKA (0.36) | KDRAURKASLC2A1PKMSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL3039578 | 0.89 | AURKA (0.41) | KDRAURKAPKMSMN1; SMN2NQO2 | |
| Hydrochloric Acid SCHEMBL3047929 | 0.89 | AURKA (0.38) | KDRAURKASLC2A1PKMSMN1; SMN2 | |
| SCHEMBL3054784 | 0.88 | AURKA (0.42) | KDRAURKAPKMSMN1; SMN2NQO2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1880993-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND | KYOWA HAKKO KOGYO CO., LTD. (JP) | 2008-01-23 | — | — | EP | disclosed |