Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | LIPE | Q05469 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | DHODH | Q02127 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.35 |
| ▸ | CSNK1D | P48730 | 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 | |
|---|---|---|---|---|
| SCHEMBL7567595 | 0.78 | TSHR (0.54) | TSHRKCNH2L3MBTL1NPC1RAB9A | |
| SCHEMBL29957669 | 0.72 | TSHR (0.50) | TSHRLIPEL3MBTL1NPC1RAB9A | |
| Hydroxyamine SCHEMBL1680424 | 0.72 | TSHR (0.83) | TSHRL3MBTL1NPC1RAB9ACA1 | |
| Hydrogen Peroxide SCHEMBL28758135 | 0.72 | TSHR (0.94) | TSHRL3MBTL1CA1KDM4ECA2 | |
| SCHEMBL29953296 | 0.71 | CCR1 (0.41) | KCNH2 | |
| SCHEMBL29950655 | 0.71 | TSHR (0.48) | TSHRLIPEL3MBTL1NPC1RAB9A | |
| SCHEMBL21266089 | 0.71 | TSHR (0.48) | TSHRKCNH2L3MBTL1NPC1RAB9A | |
| SCHEMBL20604722 | 0.70 | TSHR (0.47) | TSHRLIPEL3MBTL1RAB9ASMN1; SMN2 | |
| SCHEMBL178228 | 0.70 | TSHR (0.62) | TSHRLIPECA1KDM4ECA2 | |
| SCHEMBL19605335 | 0.70 | PARP1 (0.38) | KCNH2BRD4 |
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 |