Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | CASP7 | P55210 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9918669 | 0.83 | — | — | |
| SCHEMBL11451905 | 0.78 | HCAR2 (0.38) | ALDH1A1LMNATSHRESR1CHRM1 | |
| SCHEMBL11445756 | 0.77 | HCAR2 (0.36) | ALDH1A1LMNATSHRESR1CHRM1 | |
| SCHEMBL4250375 | 0.75 | HCAR2 (0.41) | ALDH1A1LMNATSHRESR1CHRM1 | |
| SCHEMBL11509599 | 0.75 | HCAR2 (0.41) | ALDH1A1LMNATSHRESR1CHRM1 | |
| SCHEMBL27546784 | 0.75 | — | — | |
| SCHEMBL667294 | 0.73 | HCAR2 (0.34) | ALDH1A1LMNATSHRESR1CHRM1 | |
| SCHEMBL4734757 | 0.73 | HDAC1 (0.35) | ALDH1A1LMNATSHRESR1CHRM1 | |
| SCHEMBL37003 | 0.73 | — | — | |
| SCHEMBL28320811 | 0.73 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-56071049-A | — | — | None | — | — | JP | disclosed |
| JP-S5671049-A | PREPARATION OF AMINO ACID ESTER | UBE IND LTD | 1981-06-13 | — | — | JP | disclosed |