Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.31 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8068484 | 0.94 | ALDH1A1 (0.37) | ALDH1A1KDM4EALOX15ATMCA1 | |
| SCHEMBL8057641 | 0.87 | EPHX1 (0.33) | ALDH1A1KDM4EALOX15ATM | |
| SCHEMBL8067983 | 0.84 | ALOX15 (0.35) | ALDH1A1KDM4EALOX15ATMCA1 | |
| SCHEMBL8057784 | 0.82 | MTNR1A (0.31) | SMN1; SMN2 | |
| SCHEMBL8057810 | 0.81 | ALOX15 (0.33) | ALDH1A1KDM4EALOX15 | |
| Hydrochloric Acid SCHEMBL8073383 | 0.81 | EPHX1 (0.35) | ALDH1A1KDM4EALOX15ATM | |
| SCHEMBL8069547 | 0.81 | ALOX15 (0.33) | ALDH1A1KDM4EALOX15 | |
| SCHEMBL8058358 | 0.80 | SMN1; SMN2 (0.36) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL8066747 | 0.79 | ALDH1A1 (0.34) | ALDH1A1KDM4EALOX15 | |
| Hydrochloric Acid SCHEMBL8072210 | 0.76 | MTNR1A (0.32) | SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6127496-A | POLYMERIZING OLEFINICALLY UNSATURATED COMPOUNDS IN PRESENCE OF METALLOCENE CATALYST SYSTEM CONTAINING A COMPOUND CAPABLE OF FORMING METALLOCENIUM IONS | BASF AKTIENGESELLSCHAFT (DE) | 2000-10-03 | — | — | US | disclosed |
| US-6077965-A | Metal complexes with an adamantane-like structure | BASF AKTIENGESELLSCHAFT (DE) | 2000-06-20 | — | — | US | disclosed |