Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ANPEP | P15144 | 1/20 | 0.47 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | S1PR2 | O95136 | 5/20 | 0.41 |
| ▸ | S1PR4 | O95977 | 5/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.41 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.41 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 2/20 | 0.40 |
| ▸ | ADH1B | P00325 | 1/20 | 0.39 |
| ▸ | ADH1C | P00326 | 1/20 | 0.39 |
| ▸ | ADH1A | P07327 | 1/20 | 0.39 |
| ▸ | ADH4 | P08319 | 1/20 | 0.39 |
| ▸ | ADH7 | P40394 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | GRIA1 | P42261 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14603042 | 1.00 | ANPEP (0.47) | ANPEPERAP2EPHX1CA1CA2 | |
| SCHEMBL21518423 | 1.00 | ANPEP (0.47) | ANPEPERAP2EPHX1CA1CA2 | |
| SCHEMBL4143314 | 0.98 | ANPEP (0.45) | ANPEPERAP2EPHX1CA1CA2 | |
| SCHEMBL21518400 | 0.95 | ANPEP (0.41) | ANPEPERAP2EPHX1CA1CA2 | |
| SCHEMBL21518361 | 0.87 | ANPEP (0.40) | ANPEPERAP2EPHX1CA1PPARA | |
| SCHEMBL21623896 | 0.87 | ANPEP (0.40) | ANPEPERAP2EPHX1CA1PPARA | |
| SCHEMBL10231077 | 0.82 | ANPEP (0.47) | ANPEPERAP2EPHX1CA1CA2 | |
| SCHEMBL27530697 | 0.82 | ANPEP (0.47) | ANPEPERAP2EPHX1CA1CA2 | |
| Hydrochloric Acid SCHEMBL8962180 | 0.81 | ANPEP (0.46) | ANPEPERAP2EPHX1CA1CA2 | |
| SCHEMBL11047329 | 0.80 | ANPEP (0.45) | ANPEPERAP2EPHX1CA1CA2 |
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-3824009-A1 | IONICALLY HYDROPHILIZED POLYISOCYANATES WITH IMPROVED DRYING | Covestro Intellectual Property GmbH & Co. KG (DE) | 2021-05-26 | — | — | EP | disclosed |
| WO-2020016116-A1 | IONICALLY HYDROPHILIZED POLYISOCYANATES WITH IMPROVED DRYING | COVESTRO DEUTSCHLAND AG (DE) | 2020-01-23 | — | — | WO | disclosed |