Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11541602 | 0.81 | NR1I2 (0.57) | NR1I2NPSR1KCNH2AOX1POLB | |
| SCHEMBL8661673 | 0.81 | NR1I2 (0.53) | NR1I2NPSR1KCNH2AOX1POLB | |
| SCHEMBL5002639 | 0.81 | NR1I2 (0.53) | NR1I2NPSR1KCNH2AOX1POLB | |
| SCHEMBL1358566 | 0.78 | TSHR (0.60) | NR1I2MEN1KMT2ALMNAALDH1A1 | |
| Triethyl Phosphate SCHEMBL21823232 | 0.74 | NR1I2 (0.54) | NR1I2NPSR1KCNH2AOX1POLB | |
| SCHEMBL20710724 | 0.74 | NR1I2 (0.46) | NR1I2NPSR1KCNH2AOX1POLB | |
| SCHEMBL7715297 | 0.73 | NPSR1 (0.50) | NR1I2NPSR1KCNH2AOX1POLB | |
| SCHEMBL3317654 | 0.73 | ACHE (0.50) | NR1I2NPSR1KCNH2AOX1POLB | |
| SCHEMBL8161473 | 0.72 | NR1I2 (1.00) | NR1I2NPSR1KCNH2AOX1POLB | |
| Benzene SCHEMBL25317681 | 0.72 | NPSR1 (0.47) | NR1I2NPSR1KCNH2AOX1POLB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4470841-A | Certain herbicidal phosphonates | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1984-09-11 | — | — | US | disclosed |
| EP-0073040-A2 | Organic phosphorus compounds, and their production and use | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1983-03-02 | — | — | EP | disclosed |
| US-4150223-A | ANTIBIOTICS | MERCK & CO., INC. (US) | 1979-04-17 | — | — | US | disclosed |
| US-4032521-A | ANTIBIOTICS | MERCK & CO., INC. (US) | 1977-06-28 | — | — | US | disclosed |