Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | LOX | P28300 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9694533 | 0.79 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL9695709 | 0.76 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL9696024 | 0.73 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL9695688 | 0.71 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL9695795 | 0.70 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL9695670 | 0.68 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL9696052 | 0.67 | KDM4E (0.50) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL9696036 | 0.67 | ALDH1A1 (0.42) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL9696730 | 0.67 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL9695635 | 0.66 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992007468-A1 | HERBICIDES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-05-14 | — | — | WO | disclosed |