Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 7/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 7/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 7/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.37 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL23604409 | 0.90 | ADRB2 (0.48) | SMN1; SMN2ALDH1A1TSHRADRB2ADRB1 | |
| SCHEMBL23604408 | 0.84 | ADRB2 (0.43) | TP53SMN1; SMN2ALDH1A1TSHRADRB2 | |
| SCHEMBL23604411 | 0.83 | NPC1 (0.42) | ALDH1A1TSHRADRB2ADRB1ADRB3 | |
| SCHEMBL23604406 | 0.83 | ADRB2 (0.49) | SMN1; SMN2ALDH1A1TSHRADRB2ADRB1 | |
| SCHEMBL23604366 | 0.73 | ADRB2 (0.38) | ALDH1A1TSHRMAPK1ADRB2ADRB1 | |
| SCHEMBL15237076 | 0.73 | TSHR (0.65) | TP53ALDH1A1TSHRMAPK1ADRB2 | |
| SCHEMBL9121903 | 0.71 | ALDH1A1 (0.41) | TP53SMN1; SMN2ALDH1A1TSHRMAPK1 | |
| SCHEMBL23604743 | 0.70 | ADRB2 (0.41) | ALDH1A1TSHRADRB2ADRB1ADRB3 | |
| SCHEMBL23604744 | 0.70 | ADRB2 (0.51) | ALDH1A1TSHRADRB2ADRB1ADRB3 | |
| SCHEMBL9124579 | 0.69 | ALDH1A1 (0.52) | ALDH1A1TSHRMAPK1GAAL3MBTL1 |
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-20210198472-A1 | MATERIAL FOR FORMING ORGANIC FILM, METHOD FOR FORMING ORGANIC FILM, PATTERNING PROCESS, AND COMPOUND | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2021-07-01 | — | — | US | disclosed |