Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 3/20 | 0.60 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.60 |
| ▸ | AGPAT2 | O15120 | 6/20 | 0.56 |
| ▸ | CDK9 | P50750 | 4/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | CASP3 | P42574 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.54 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.54 |
| ▸ | RELA | Q04206 | 1/20 | 0.54 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.54 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.54 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8410115 | 0.81 | ALDH1A1 (0.71) | HTR2BPDE4DAGPAT2CDK9SMN1; SMN2 | |
| SCHEMBL8413195 | 0.78 | HTR2B (0.57) | HTR2BPDE4DAGPAT2CDK9SMN1; SMN2 | |
| SCHEMBL4366463 | 0.77 | AGPAT2 (0.70) | HTR2BPDE4DAGPAT2CDK9SMN1; SMN2 | |
| Irsogladine SCHEMBL29517870 | 0.77 | HTR2B (1.00) | HTR2BPDE4DAGPAT2CDK9SMN1; SMN2 | |
| Irsogladine SCHEMBL62215 | 0.77 | HTR2B (1.00) | HTR2BPDE4DAGPAT2CDK9SMN1; SMN2 | |
| SCHEMBL8411018 | 0.76 | HTR2B (0.63) | HTR2BPDE4DAGPAT2CDK9SMN1; SMN2 | |
| SCHEMBL8410276 | 0.76 | CDK9 (0.57) | HTR2BPDE4DAGPAT2CDK9SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL8414054 | 0.75 | HTR2B (0.61) | HTR2BPDE4DAGPAT2CDK9SMN1; SMN2 | |
| SCHEMBL8410960 | 0.75 | HTR2B (0.61) | HTR2BPDE4DAGPAT2CDK9SMN1; SMN2 | |
| SCHEMBL2622387 | 0.75 | AGPAT2 (0.66) | HTR2BPDE4DAGPAT2CDK9SMN1; SMN2 |
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-0563386-A1 | ANTICANCER COMPOSITION AND COMPOUND | NIPPON SHINYAKU COMPANY, LIMITED (JP) | 1993-10-06 | — | — | EP | disclosed |