Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | NOS3 | P29474 | 2/20 | 0.36 |
| ▸ | NOS1 | P29475 | 2/20 | 0.36 |
| ▸ | NOS2 | P35228 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9458330 | 1.00 | CA1 (0.42) | CA1CA2CHRM4CHRM5CHRM1 | |
| SCHEMBL6680468 | 0.81 | CHRM4 (0.44) | CHRM4CHRM5CHRM1CHRM3ALDH1A1 | |
| SCHEMBL6677373 | 0.81 | CHRM4 (0.44) | CHRM4CHRM5CHRM1CHRM3ALDH1A1 | |
| SCHEMBL8065451 | 0.81 | CHRM4 (0.44) | CHRM4CHRM5CHRM1CHRM3ALDH1A1 | |
| SCHEMBL29369642 | 0.81 | CHRM4 (0.44) | CHRM4CHRM5CHRM1CHRM3ALDH1A1 | |
| SCHEMBL28072033 | 0.79 | CHRM4 (0.40) | CA1CA2CHRM4CHRM5CHRM1 | |
| SCHEMBL27601409 | 0.79 | CHRM4 (0.40) | CHRM4CHRM5CHRM1CHRM3ALDH1A1 | |
| SCHEMBL9458565 | 0.79 | CA2 (0.55) | CA1CA2ZDHHC7TSHRMAPT | |
| SCHEMBL12518959 | 0.78 | CA1 (0.43) | CA1CA2SMN1; SMN2CA14ALDH1A1 | |
| SCHEMBL15041053 | 0.78 | CA1 (0.43) | CA1CA2SMN1; SMN2CA14POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008151306-A1 | SYNTHESIS OF CYCLODEPSIPEPTIDE COMPOUNDS HAVING ANTINEOPLASTIC AND/OR ANTIMICROBIAL ACTIVITY | ARIZONA BOARD OF REGENTS, A BODY CORPORATE OF THE STATE OF ARIZONA, ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) | 2008-12-11 | — | — | WO | disclosed |