Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.63 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.63 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.63 |
| ▸ | CA12 | O43570 | 2/20 | 0.58 |
| ▸ | CA1 | P00915 | 2/20 | 0.58 |
| ▸ | CA2 | P00918 | 2/20 | 0.58 |
| ▸ | CA9 | Q16790 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.52 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.52 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.52 |
| ▸ | DRD4 | P21917 | 2/20 | 0.51 |
| ▸ | DRD3 | P35462 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL29950821 | 0.98 | SIGMAR1 (0.60) | SIGMAR1CHRM5CHRM3CA12CA1 | |
| SCHEMBL29956260 | 0.92 | SIGMAR1 (0.51) | SIGMAR1CHRM5CHRM3CA12CA1 | |
| SCHEMBL29957446 | 0.85 | SIGMAR1 (0.60) | SIGMAR1CHRM5CHRM3CA12CA1 | |
| SCHEMBL2556726 | 0.85 | SIGMAR1 (0.46) | SIGMAR1CHRM5CHRM3CA12CA1 | |
| SCHEMBL15332158 | 0.85 | KMT2A (0.47) | SIGMAR1CHRM5CHRM3CA12CA1 | |
| SCHEMBL29953482 | 0.84 | SIGMAR1 (0.59) | SIGMAR1CHRM5CHRM3CA12CA1 | |
| SCHEMBL29955589 | 0.84 | SIGMAR1 (0.59) | SIGMAR1CHRM5CHRM3CA12CA1 | |
| SCHEMBL6479844 | 0.83 | SIGMAR1 (0.75) | SIGMAR1CHRM5CHRM3CA12CA1 | |
| SCHEMBL29954761 | 0.82 | SIGMAR1 (0.57) | SIGMAR1CHRM5CHRM3CA12CA1 | |
| SCHEMBL974452 | 0.81 | SIGMAR1 (0.66) | SIGMAR1CHRM5CHRM3CA12CA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |