Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 2/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.43 |
| ▸ | NOS2 | P35228 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MDM4 | O15151 | 1/20 | 0.39 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | CDK2 | P24941 | 2/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MIF | P14174 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | FPR2 | P25090 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL163965 | 0.86 | NOS2 (0.47) | ESR1ESR2NOS2ALDH1A1POLB | |
| SCHEMBL4816689 | 0.80 | ESR1 (0.63) | NLRP3ESR1ESR2MDM4MDM2 | |
| SCHEMBL7496453 | 0.78 | NOS2 (0.42) | ESR1ESR2NOS2ALDH1A1POLB | |
| SCHEMBL3204956 | 0.75 | ATM (0.53) | ALDH1A1MIFPOLBL3MBTL1 | |
| SCHEMBL977403 | 0.74 | ESR1 (0.46) | ESR1ESR2NOS2ALDH1A1MIF | |
| Ammonia Solution, Strong SCHEMBL20513680 | 0.74 | ATM (0.51) | ALDH1A1MIFPOLBL3MBTL1 | |
| SCHEMBL3248350 | 0.74 | L3MBTL1 (0.49) | ESR1ESR2ALDH1A1MIFL3MBTL1 | |
| Methylene Chloride SCHEMBL29038775 | 0.72 | ATM (0.50) | NOS2ALDH1A1MIFPOLBL3MBTL1 | |
| SCHEMBL5672844 | 0.72 | LDHA (0.59) | ALDH1A1POLBFPR2 | |
| SCHEMBL15180970 | 0.72 | PTPRB (0.58) | ESR1ESR2NOS2ALDH1A1POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-3724387-A1 | METHOD FOR PRODUCING A REINFORCING SUPPORT FOR REINFORCING RUBBER PRODUCTS, REINFORCING SUPPORT, AND USE OF THE REINFORCING SUPPORT | Continental Reifen Deutschland GmbH (DE) | 2020-10-21 | — | — | EP | disclosed |