Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ASPH | Q12797 | 1/20 | 0.35 |
| ▸ | KDM8 | Q8N371 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 2/20 | 0.32 |
| ▸ | KDM4A | O75164 | 1/20 | 0.32 |
| ▸ | KDM5A | P29375 | 1/20 | 0.32 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.32 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.32 |
| ▸ | ACLY | P53396 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14408181 | 1.00 | KEAP1 (0.42) | KEAP1NFE2L2CYP3A4KDM4EASPH | |
| SCHEMBL14408184 | 1.00 | KEAP1 (0.42) | KEAP1NFE2L2CYP3A4KDM4EASPH | |
| SCHEMBL5357933 | 0.81 | KEAP1 (0.46) | KEAP1NFE2L2CYP3A4KDM4EASPH | |
| SCHEMBL8974977 | 0.74 | KEAP1 (0.53) | KEAP1NFE2L2CYP3A4KDM4EASPH | |
| SCHEMBL14408185 | 0.74 | HPGD (0.36) | CYP3A4ALDH1A1POLBSMN1; SMN2CA12 | |
| SCHEMBL25281495 | 0.70 | KDM4E (0.36) | CYP3A4KDM4EKMT2AACLYALDH1A1 | |
| SCHEMBL7596205 | 0.69 | KEAP1 (0.48) | KEAP1NFE2L2CYP3A4KDM4EASPH | |
| SCHEMBL10539386 | 0.69 | KEAP1 (0.48) | KEAP1NFE2L2CYP3A4KDM4EASPH | |
| SCHEMBL7041352 | 0.69 | CYP3A4 (0.50) | KEAP1NFE2L2CYP3A4KDM4EASPH | |
| SCHEMBL8038276 | 0.69 | KEAP1 (0.48) | KEAP1NFE2L2CYP3A4KDM4EASPH |
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 |
|---|---|---|---|---|---|---|---|
| US-7268248-B2 | Bichlorinated compounds formed under with carboxy groupand elimation of water | BAYER AKTIENGESELLSCHAFT (DE) | 2007-09-11 | — | — | US | disclosed |
| US-7268248-B2 | Bichlorinated compounds formed under with carboxy groupand elimation of water | BAYER AKTIENGESELLSCHAFT (DE) | 2007-09-11 | — | — | US | disclosed |