Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 2/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | XIAP | P98170 | 1/20 | 0.36 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.36 |
| ▸ | ADA | P00813 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | NNMT | P40261 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL3935150 | 0.87 | PIM1 (0.43) | PIM1PARP1KDM4EALOX15TSHR | |
| SCHEMBL9298348 | 0.85 | PIM1 (0.42) | PIM1PARP1IRAK4KDM4EALOX15 | |
| SCHEMBL23491120 | 0.84 | PIM1 (0.45) | PIM1PARP1KDM4EALOX15TSHR | |
| SCHEMBL21883573 | 0.81 | PIM1 (0.39) | PIM1PARP1KDM4EALOX15TSHR | |
| SCHEMBL29049789 | 0.81 | P2RX7 (0.60) | IRAK4CNR2P2RX7CYP1A2ALDH1A1 | |
| SCHEMBL22234567 | 0.79 | PIM1 (0.43) | PIM1IRAK4KDM4EALOX15TSHR | |
| SCHEMBL29444559 | 0.79 | PIM1 (0.43) | PIM1IRAK4KDM4EALOX15TSHR | |
| Hydrochloric Acid SCHEMBL31211911 | 0.78 | PIM1 (0.42) | PIM1IRAK4KDM4EALOX15TSHR | |
| SCHEMBL522063 | 0.77 | CYP1A2 (0.38) | IRAK4LMNACYP1A2ALDH1A1 | |
| Pyridine Dicarboxamide SCHEMBL29587789 | 0.77 | TSHR (0.59) | PIM1PARP1KDM4EALOX15TSHR |
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-116410441-A | Water-based polyurethane-acrylate emulsion and preparation method thereof | 万华化学集团股份有限公司 | 2023-07-11 | — | — | CN | disclosed |