Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | HTR7 | P34969 | 3/20 | 0.32 |
| ▸ | PDE4A | P27815 | 2/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.31 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.31 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.31 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 3/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | BRD4 | O60885 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL557549 | 0.95 | ADORA2B (0.35) | ALDH1A1HPGDKDM4EHSD17B10PDE4A | |
| SCHEMBL21772430 | 0.87 | ATM (0.30) | ATM | |
| SCHEMBL4131368 | 0.81 | APEX1 (0.42) | ALDH1A1HPGDKDM4EPDE4AADORA2A | |
| SCHEMBL3402639 | 0.80 | LMNA (0.32) | ALDH1A1PDE4AADORA2APDE4BPDE4C | |
| SCHEMBL28429834 | 0.79 | PDE4A (0.34) | ALDH1A1PDE4AADORA2APDE4BPDE4C | |
| SCHEMBL3405710 | 0.78 | LMNA (0.35) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL3402332 | 0.78 | LMNA (0.35) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL3400000 | 0.78 | LMNA (0.35) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL4129111 | 0.78 | ADORA2B (0.36) | ALDH1A1HPGDKDM4EHSD17B10PDE4A | |
| SCHEMBL4141489 | 0.77 | PDE4A (0.33) | KDM4EPDE4AADORA2APDE4BPDE4C |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113501931-B | Solvent-free low-viscosity isocyanate composition and preparation method and application thereof | 万华化学集团股份有限公司 | 2022-07-12 | — | — | CN | claimed |
| CN-113501931-A | Solvent-free low-viscosity isocyanate composition and preparation method and application thereof | 万华化学集团股份有限公司 | 2021-10-15 | — | — | CN | claimed |
| CN-113501931-B | Solvent-free low-viscosity isocyanate composition and preparation method and application thereof | 万华化学集团股份有限公司 | 2022-07-12 | — | — | CN | disclosed |
| CN-113501931-A | Solvent-free low-viscosity isocyanate composition and preparation method and application thereof | 万华化学集团股份有限公司 | 2021-10-15 | — | — | CN | disclosed |