Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.66 |
| ▸ | HPGD | P15428 | 6/20 | 0.66 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.66 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.66 |
| ▸ | MEN1 | O00255 | 4/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.66 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.66 |
| ▸ | GRM1 | Q13255 | 3/20 | 0.66 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.66 |
| ▸ | BLM | P54132 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | CA1 | P00915 | 2/20 | 0.53 |
| ▸ | CA2 | P00918 | 2/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.53 |
| ▸ | CA7 | P43166 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL11233617 | 1.00 | KDM4E (0.66) | KDM4EALDH1A1HPGDHSD17B10TDP1 | |
| SCHEMBL9755165 | 0.82 | KDM4E (0.67) | KDM4EALDH1A1HPGDHSD17B10TDP1 | |
| SCHEMBL28135952 | 0.82 | BLM (0.62) | KDM4EHPGDHSD17B10TDP1MEN1 | |
| SCHEMBL10085813 | 0.82 | BLM (0.62) | KDM4EHPGDHSD17B10TDP1MEN1 | |
| SCHEMBL29881886 | 0.82 | BLM (0.62) | KDM4EHPGDHSD17B10TDP1MEN1 | |
| SCHEMBL43825 | 0.82 | BLM (0.62) | KDM4EHPGDHSD17B10TDP1MEN1 | |
| SCHEMBL29935536 | 0.82 | BLM (0.62) | KDM4EHPGDHSD17B10TDP1MEN1 | |
| SCHEMBL43826 | 0.82 | BLM (0.62) | KDM4EHPGDHSD17B10TDP1MEN1 | |
| SCHEMBL14381820 | 0.81 | KDM4E (0.61) | KDM4EALDH1A1HPGDHSD17B10TDP1 | |
| SCHEMBL10786647 | 0.80 | BLM (0.61) | KDM4EHPGDHSD17B10TDP1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0028375-B1 | PROCESS FOR THE PREPARATION OF PHENYLACETIC ACID AND ITS SIMPLE DERIVATIVES | HOECHST AKTIENGESELLSCHAFT (DE) | 1982-12-08 | — | — | EP | disclosed |
| US-4339594-A | HYDROGENATION, HYDROGENATION CATALYSTS | HOECHST AKTIENGESELLSCHAFT (DE) | 1982-07-13 | — | — | US | disclosed |
| EP-0028375-A1 | Process for the preparation of phenylacetic acid and its simple derivatives | HOECHST AKTIENGESELLSCHAFT (DE) | 1981-05-13 | — | — | EP | disclosed |