Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRC | P12931 | 1/20 | 0.52 |
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.49 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.47 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.46 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.46 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | RARB | P10826 | 1/20 | 0.43 |
| ▸ | RARG | P13631 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TYR | P14679 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | KIF11 | P52732 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6951155 | 0.98 | SRC (0.54) | SRCNR1H4SRD5A2AKR1C3AKR1C2 | |
| SCHEMBL21268997 | 0.96 | SRC (0.52) | SRCNR1H4SRD5A2AKR1C3AKR1C2 | |
| SCHEMBL28314648 | 0.96 | SRC (0.52) | SRCNR1H4SRD5A2AKR1C3AKR1C2 | |
| SCHEMBL21269797 | 0.96 | SRC (0.52) | SRCNR1H4SRD5A2AKR1C3AKR1C2 | |
| SCHEMBL28314762 | 0.96 | SRC (0.52) | SRCNR1H4SRD5A2AKR1C3AKR1C2 | |
| SCHEMBL21269219 | 0.96 | SRC (0.52) | SRCNR1H4SRD5A2AKR1C3AKR1C2 | |
| SCHEMBL28314572 | 0.94 | SRC (0.50) | SRCNR1H4SRD5A2AKR1C3AKR1C2 | |
| SCHEMBL3591632 | 0.81 | NR1H4 (0.50) | NR1H4SRD5A2AKR1C3AKR1C2FFAR1 | |
| Iodide SCHEMBL31045512 | 0.79 | NR1H4 (0.53) | NR1H4SRD5A2AKR1C3AKR1C2FFAR1 | |
| SCHEMBL11238948 | 0.79 | LMNA (0.56) | NR1H4SRD5A2AKR1C3AKR1C2FFAR1 |
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-110172019-A | The metal salt of malonic acid as the nucleating additive for crystalline thermoplastic | 印度石油有限公司 | 2019-08-27 | — | — | CN | claimed |