Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.43 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.43 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | PORCN | Q9H237 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7979735 | 0.87 | CYP1A2 (0.47) | CYP3A4MEN1KMT2ACYP2D6CYP2C9 | |
| Bromide SCHEMBL28236890 | 0.77 | ALDH1A1 (0.46) | CYP3A4TSHRMEN1KMT2ACYP2D6 | |
| 2-Bromoethanol SCHEMBL10509191 | 0.76 | CYP3A4 (0.72) | CYP3A4TSHRMEN1ALOX15KMT2A | |
| SCHEMBL451 | 0.75 | CYP3A4 (1.00) | CYP3A4TSHRMEN1ALOX15KMT2A | |
| SCHEMBL4314558 | 0.74 | PDE4A (0.47) | CYP3A4MEN1KMT2ACYP2D6CYP2C9 | |
| Bromide SCHEMBL1954236 | 0.74 | CYP3A4 (0.95) | CYP3A4TSHRMEN1ALOX15KMT2A | |
| SCHEMBL14157261 | 0.74 | CYP3A4 (0.95) | CYP3A4TSHRMEN1ALOX15KMT2A | |
| Hydrochloric Acid SCHEMBL8898731 | 0.74 | CYP3A4 (0.95) | CYP3A4TSHRMEN1ALOX15KMT2A | |
| Iodide SCHEMBL28722278 | 0.74 | CYP3A4 (0.95) | CYP3A4TSHRMEN1ALOX15KMT2A | |
| Hydrochloric Acid SCHEMBL410291 | 0.74 | CYP3A4 (0.95) | CYP3A4TSHRMEN1ALOX15KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0876370-A1 | CARBAPENEM COMPOUNDS, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1998-11-11 | — | — | EP | disclosed |
| WO-1997025325-A1 | CARBAPENEM COMPOUNDS, THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1997-07-17 | — | — | WO | disclosed |