Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPB1 | P15086 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.36 |
| ▸ | TPSD1 | Q9BZJ3 | 1/20 | 0.36 |
| ▸ | TPSG1 | Q9NRR2 | 1/20 | 0.36 |
| ▸ | NAAA | Q02083 | 3/20 | 0.36 |
| ▸ | TACR1 | P25103 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30233957 | 1.00 | CPB1 (0.41) | CPB1ALDH1A1GAACYP3A4CYP2D6 | |
| SCHEMBL22227917 | 0.86 | L3MBTL1 (0.38) | ALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL22227918 | 0.86 | L3MBTL1 (0.38) | ALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL30233895 | 0.82 | CPB1 (0.48) | CPB1ALDH1A1GAATACR1SMN1; SMN2 | |
| SCHEMBL28897095 | 0.82 | CPB1 (0.48) | CPB1ALDH1A1GAATACR1SMN1; SMN2 | |
| SCHEMBL28439036 | 0.80 | CPB1 (0.44) | CPB1ALDH1A1GAATACR1SMN1; SMN2 | |
| SCHEMBL29483860 | 0.80 | CPB1 (0.46) | CPB1ALDH1A1GAANAAATACR1 | |
| SCHEMBL22227862 | 0.78 | CPB1 (0.42) | CPB1ALDH1A1GAASMN1; SMN2TSHR | |
| SCHEMBL20832767 | 0.77 | L3MBTL1 (0.34) | — | |
| SCHEMBL33374588 | 0.76 | L3MBTL1 (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-111094255-A | Compound having cyclic structure | 第一三共株式会社 | 2020-05-01 | — | — | CN | disclosed |