Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 6/20 | 0.40 |
| ▸ | RPS6KB1 | P23443 | 3/20 | 0.36 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.35 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4951728 | 0.84 | PARP1 (0.42) | PARP1RPS6KB1CXCR2IRAK4KEAP1 | |
| SCHEMBL45719 | 0.79 | PARP1 (0.51) | PARP1IRAK4KEAP1NFE2L2KDM4E | |
| SCHEMBL72113 | 0.76 | PARP1 (0.49) | PARP1IRAK4KEAP1NFE2L2KDM4E | |
| SCHEMBL8898159 | 0.76 | CYP3A4 (0.42) | PARP1RPS6KB1ALDH1A1MAPTTSHR | |
| SCHEMBL30499962 | 0.75 | MAPK8 (0.47) | PARP1KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL19695740 | 0.75 | MAPK8 (0.47) | PARP1KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL17182410 | 0.75 | KDM4E (0.40) | PARP1RPS6KB1CXCR2KDM4EALDH1A1 | |
| Charcoal, Activated SCHEMBL9345241 | 0.74 | PARP1 (0.47) | PARP1IRAK4KEAP1NFE2L2KDM4E | |
| SCHEMBL6321332 | 0.74 | PARP1 (0.47) | PARP1IRAK4KEAP1NFE2L2KDM4E | |
| Hydrochloric Acid SCHEMBL7467552 | 0.74 | PARP1 (0.47) | PARP1IRAK4KEAP1NFE2L2KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2040555-A2 | FORMULATED TICK AND INSECT REPELLENT COMPOSITIONS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2009-04-01 | — | — | EP | disclosed |
| WO-2007133683-A2 | FORMULATED TICK AND INSECT REPELLENT COMPOSITIONS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2007-11-22 | — | — | WO | disclosed |