Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 9/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.42 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL30706206 | 1.00 | TBXAS1 (0.47) | TBXAS1MAPK1TSHRALDH1A1LMNA | |
| SCHEMBL4826686 | 0.87 | NAPRT (0.53) | MAPK1TSHRALDH1A1LMNAKDM4E | |
| SCHEMBL7033315 | 0.83 | FFAR1 (0.38) | ALDH1A1LMNACYP1A2CYP3A4TNKS2 | |
| SCHEMBL436079 | 0.83 | TDP1 (0.54) | MAPK1ALDH1A1HTTMEN1GAA | |
| SCHEMBL17767816 | 0.81 | PSMB8 (0.42) | MAPK1ALDH1A1KMT2ATDP1 | |
| SCHEMBL19658184 | 0.81 | TDP1 (0.42) | TDP1 | |
| SCHEMBL24636717 | 0.80 | HTT (0.42) | TBXAS1MAPK1TSHRALDH1A1LMNA | |
| SCHEMBL13196040 | 0.79 | CYP3A4 (0.52) | MAPK1TSHRALDH1A1LMNAKDM4E | |
| SCHEMBL1491215 | 0.78 | CYP19A1 (0.48) | MAPK1TSHRALDH1A1LMNAKDM4E | |
| SCHEMBL9398031 | 0.78 | SMN1; SMN2 (0.42) | MAPK1TSHRALDH1A1LMNAHTT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117377468-A | 2, 6-dichlorophenyl ester compound and application thereof | 融合制药公司 | 2024-01-09 | — | — | CN | disclosed |
| WO-2023137518-A1 | PLATINUM COMPLEXES | Western Sydney University (AU) | 2023-07-27 | — | — | WO | disclosed |
| WO-2022251612-A1 | 2,6-DICHLOROPHENYL ESTER COMPOUNDS AND USE THEREOF | Fusion Pharmaceuticals Inc. (CA) | 2022-12-01 | — | — | WO | disclosed |