Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA3 | P07451 | 2/20 | 0.40 |
| ▸ | CA4 | P22748 | 2/20 | 0.40 |
| ▸ | CA6 | P23280 | 2/20 | 0.40 |
| ▸ | CA7 | P43166 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CYSLTR1 | Q9Y271 | 2/20 | 0.40 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4720632 | 0.79 | HDAC1 (0.51) | KDM4EMEN1ALDH1A1KMT2ACYP1A2 | |
| SCHEMBL27559613 | 0.79 | KDM4E (0.40) | CYSLTR1GPBAR1KDM4EMEN1ALDH1A1 | |
| SCHEMBL1641523 | 0.79 | HDAC1 (0.52) | KDM4EMEN1ALDH1A1KMT2ACYP1A2 | |
| SCHEMBL9697024 | 0.78 | CYSLTR1 (0.42) | CA12CA2CA3CA4CA6 | |
| SCHEMBL21585550 | 0.77 | PTGS1 (0.62) | PTGS1AKR1C3AKR1C2CA12CA2 | |
| SCHEMBL28435714 | 0.75 | PTGS1 (0.56) | PTGS1AKR1C3AKR1C2CA12CA2 | |
| SCHEMBL5470951 | 0.75 | BACE1 (0.51) | KDM4EMEN1KMT2AAKR1B1RXRA | |
| SCHEMBL24219858 | 0.74 | CYSLTR1 (0.40) | CA12CA2CA3CA4CA6 | |
| SCHEMBL22095064 | 0.74 | CYSLTR1 (0.40) | CA12CA2CA3CA4CA6 | |
| SCHEMBL140815 | 0.74 | CYP1A2 (0.65) | CYSLTR1GPBAR1KDM4EMEN1ALDH1A1 |
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-0632027-A1 | 6-(Carbonyloxymethylene)-quinolines | BASF Aktiengesellschaft (DE) | 1995-01-04 | — | — | EP | disclosed |