Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.47 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.47 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.47 |
| ▸ | BCL2 | P10415 | 1/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.46 |
| ▸ | HNF4A | P41235 | 1/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.45 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.45 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.45 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.45 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.45 |
| ▸ | PDE4A | P27815 | 1/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29791322 | 0.82 | PDE4B (0.55) | ALDH1A1BCL2MCL1PDE4A | |
| SCHEMBL31000063 | 0.80 | MEN1 (0.54) | ALDH1A1PTPN1PTPN2PTPN6HNF4A | |
| SCHEMBL10978801 | 0.80 | MEN1 (0.54) | ALDH1A1PTPN1PTPN2PTPN6HNF4A | |
| SCHEMBL5491735 | 0.80 | ALDH1A1 (0.63) | ALDH1A1AKR1C3CYP2C8CYP2C9MEN1 | |
| SCHEMBL27449650 | 0.79 | ALDH1A1 (0.54) | ALDH1A1AKR1C3CYP2C8CYP2C9MEN1 | |
| SCHEMBL27839362 | 0.79 | PTPN1 (0.50) | ALDH1A1PTPN1PTPN2PTPN6BCL2 | |
| SCHEMBL1666495 | 0.78 | ALDH1A1 (0.53) | ALDH1A1AKR1C3CYP2C8CYP2C9MEN1 | |
| SCHEMBL4326249 | 0.78 | BACE1 (0.56) | ALDH1A1PTPN1PTPN2PTPN6HNF4A | |
| SCHEMBL6034374 | 0.77 | HNF4A (0.70) | ALDH1A1PTPN1PTPN2PTPN6BCL2 | |
| SCHEMBL8003100 | 0.77 | ALDH1A1 (0.56) | ALDH1A1PTPN1PTPN2PTPN6AKR1C3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105238271-A | Smoke-suppression non-cured rubber bitumen waterproof coating material | TIANCHANG JINNIU WATERPROOF ANTI CORROSION MATERIAL CO LTD | 2016-01-13 | — | — | CN | disclosed |