Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | GFER | P55789 | 1/20 | 0.51 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30158675 | 0.92 | USP2 (0.54) | HTTKMT2AGFERCYP3A4CYP2C9 | |
| SCHEMBL30157877 | 0.91 | HTT (0.51) | HTTKMT2AGFERTHRBCYP3A4 | |
| SCHEMBL30157725 | 0.91 | HTT (0.51) | HTTKMT2AGFERCYP3A4CYP2C9 | |
| SCHEMBL30157585 | 0.91 | HTT (0.58) | HTTKMT2ACYP3A4CYP2C9CYP2C19 | |
| SCHEMBL30157966 | 0.91 | KMT2A (0.58) | HTTKMT2ACYP3A4CYP2C9CYP2C19 | |
| SCHEMBL30157842 | 0.90 | HTT (0.51) | HTTKMT2AGFERCYP3A4CYP2C9 | |
| SCHEMBL30157822 | 0.89 | P2RX7 (0.52) | HTTKMT2AGFERCYP3A4CYP2C9 | |
| SCHEMBL30157578 | 0.88 | KMT2A (0.51) | HTTKMT2AGFERCYP3A4CYP2C9 | |
| SCHEMBL30157767 | 0.87 | KMT2A (0.54) | HTTKMT2AGAAALDH1A1POLB | |
| SCHEMBL30157321 | 0.86 | KMT2A (0.53) | HTTKMT2ACYP3A4CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022268520-A1 | USE OF SUBSTITUTED PYRROLIDINONES OR THEIR SALTS FOR INCREASING STRESS TOLERANCE OF PLANTS | BAYER AKTIENGESELLSCHAFT (DE) | 2022-12-29 | — | — | WO | disclosed |