Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 4/20 | 0.52 |
| ▸ | CA2 | P00918 | 4/20 | 0.52 |
| ▸ | CA12 | O43570 | 2/20 | 0.52 |
| ▸ | CA7 | P43166 | 2/20 | 0.52 |
| ▸ | CA9 | Q16790 | 2/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 5/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.47 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.47 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.47 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.47 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.47 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL13984464 | 0.87 | ALDH1A1 (0.63) | ALDH1A1PTPN1CA1CA2CA12 | |
| SCHEMBL4661723 | 0.85 | ALDH1A1 (0.66) | ALDH1A1PTPN1CA1CA2CA12 | |
| SCHEMBL10286706 | 0.84 | ALDH1A1 (0.59) | ALDH1A1PTPN1CA1CA2CA12 | |
| SCHEMBL8229352 | 0.84 | ALDH1A1 (0.59) | ALDH1A1PTPN1CA1CA2CA12 | |
| SCHEMBL9925873 | 0.84 | ALDH1A1 (0.59) | ALDH1A1PTPN1CA1CA2CA12 | |
| SCHEMBL9315367 | 0.81 | ALDH1A1 (0.65) | ALDH1A1PTPN1CA1CA2CA12 | |
| SCHEMBL8184665 | 0.80 | ALDH1A1 (0.59) | ALDH1A1PTPN1CA1CA2CA12 | |
| SCHEMBL5797759 | 0.80 | ALDH1A1 (0.59) | ALDH1A1PTPN1CA1CA2CA12 | |
| SCHEMBL20514708 | 0.80 | ALDH1A1 (0.65) | ALDH1A1PTPN1CA1CA2CA12 | |
| SCHEMBL9764747 | 0.80 | ALDH1A1 (0.65) | ALDH1A1PTPN1CA1CA2CA12 |
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-2857405-A1 | Process for the trans-selective hydroboration of internal alkynes | Studiengesellschaft Kohle mbH (DE) | 2015-04-08 | — | — | EP | disclosed |