Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | RECQL | P46063 | 2/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 4/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | CRHBP | P24387 | 2/20 | 0.37 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 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 | |
|---|---|---|---|---|
| SCHEMBL17536059 | 0.82 | ESR1 (0.51) | MAPK1HTTSLC22A12NPSR1POLB | |
| SCHEMBL15336505 | 0.81 | ESR1 (0.50) | MAPK1HTTSLC22A12NPSR1POLB | |
| SCHEMBL18597398 | 0.79 | ESR2 (0.57) | MAPK1HTTSLC22A12TSHRRECQL | |
| SCHEMBL24190999 | 0.77 | CYP1A2 (0.41) | MAPK1HTTSLC22A12POLBTSHR | |
| SCHEMBL18714166 | 0.76 | SLC22A12 (0.36) | MAPK1HTTSLC22A12NPSR1POLB | |
| SCHEMBL25875540 | 0.74 | ESR2 (0.51) | MAPK1HTTSLC22A12NPSR1RECQL | |
| SCHEMBL24191563 | 0.74 | CYP1A2 (0.41) | MAPK1HTTSLC22A12POLBTSHR | |
| SCHEMBL14767449 | 0.72 | KDM4E (0.45) | MAPK1HTTTSHRRECQLMEN1 | |
| SCHEMBL16425015 | 0.72 | KDM4E (0.45) | MAPK1HTTSLC22A12POLBTSHR | |
| SCHEMBL23652505 | 0.72 | HSD17B10 (0.33) | MAPK1HTTSLC22A12ALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3172775-B1 | MATERIALS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2022-04-20 | — | — | EP | disclosed |