Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 7/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 7/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | P4HB | P07237 | 1/20 | 0.32 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.31 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.31 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.31 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | EDNRA | P25101 | 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 | |
|---|---|---|---|---|
| SCHEMBL1603871 | 0.83 | ACHE (0.50) | MTNR1AMTNR1BACHECA1CA2 | |
| SCHEMBL5492607 | 0.74 | CA12 (0.33) | CA1CA2CA7CA9CYP1A1 | |
| SCHEMBL23252501 | 0.72 | ACHE (0.48) | ACHEALDH1A1CYP3A4DDB1CRBN | |
| SCHEMBL28194454 | 0.71 | ACHE (0.50) | MTNR1AMTNR1BACHECA1CA2 | |
| SCHEMBL5919465 | 0.71 | ALDH1A1 (0.46) | ACHECA1CA2CA7CA9 | |
| SCHEMBL12191284 | 0.71 | ALDH1A1 (0.48) | CA1CA2CA7CA9ALDH1A1 | |
| SCHEMBL7185597 | 0.71 | MTNR1A (0.32) | MTNR1AMTNR1BCA1CA2CA7 | |
| SCHEMBL9222429 | 0.71 | LMNA (0.64) | ALDH1A1 | |
| SCHEMBL27518549 | 0.70 | — | — | |
| SCHEMBL10991025 | 0.69 | — | — |
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-1426386-B1 | Catalyst component for polymerization of olefins | MARUZEN PETROCHEM CO LTD (JP) | 2007-05-30 | — | — | EP | disclosed |