Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.32 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 2/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.30 |
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 SCHEMBL8073534 | 0.95 | SMN1; SMN2 (0.36) | SMN1; SMN2MTNR1AMTNR1BCNR2EPHX1 | |
| SCHEMBL8058358 | 0.91 | SMN1; SMN2 (0.36) | SMN1; SMN2MTNR1AMTNR1BCNR2ALDH1A1 | |
| SCHEMBL8068959 | 0.88 | EPHX1 (0.32) | EPHX1 | |
| Hydrochloric Acid SCHEMBL8071519 | 0.86 | SMN1; SMN2 (0.38) | SMN1; SMN2MTNR1AMTNR1BCNR2ALDH1A1 | |
| SCHEMBL8067398 | 0.85 | SMN1; SMN2 (0.37) | SMN1; SMN2MTNR1AMTNR1BCNR2ALDH1A1 | |
| SCHEMBL8068965 | 0.84 | SMN1; SMN2 (0.36) | SMN1; SMN2MTNR1AMTNR1BCNR2ALDH1A1 | |
| SCHEMBL8057641 | 0.83 | EPHX1 (0.33) | EPHX1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8066852 | 0.83 | EPHX1 (0.33) | SMN1; SMN2MTNR1AMTNR1BEPHX1HPGD | |
| SCHEMBL8068453 | 0.83 | SMN1; SMN2 (0.36) | SMN1; SMN2MTNR1AMTNR1BCNR2ALDH1A1 | |
| SCHEMBL8071405 | 0.82 | SMN1; SMN2 (0.35) | SMN1; SMN2MTNR1AMTNR1BCNR2ALDH1A1 |
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 |