Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.50 |
| ▸ | NCK1 | P16333 | 1/20 | 0.47 |
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.42 |
| ▸ | NQO2 | P16083 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | PDE2A | O00408 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1091674 | 0.85 | CYP1A2 (0.54) | CYP1A2NCK1BACE1ALDH1A1CYP2A6 | |
| SCHEMBL3742742 | 0.80 | CYP1A2 (0.47) | CYP1A2NCK1BACE1ALDH1A1CYP2A6 | |
| SCHEMBL698703 | 0.80 | ALDH1A1 (0.42) | ALDH1A1CYP2A6MEN1KMT2AKDM4E | |
| SCHEMBL2989781 | 0.80 | CYP1A2 (0.47) | CYP1A2NCK1BACE1ALDH1A1CYP2A6 | |
| SCHEMBL19359 | 0.78 | CYP1A2 (0.46) | CYP1A2BACE1ALDH1A1CYP2A6NQO2 | |
| SCHEMBL27931348 | 0.77 | CYP1A2 (0.44) | CYP1A2NCK1BACE1ALDH1A1CYP2A6 | |
| SCHEMBL2251224 | 0.76 | CYP1A2 (0.43) | CYP1A2NCK1BACE1ALDH1A1CYP2A6 | |
| SCHEMBL2371400 | 0.72 | CYP1A2 (0.62) | CYP1A2NCK1BACE1ALDH1A1CYP2A6 | |
| SCHEMBL5949423 | 0.72 | AR (0.36) | CYP1A2BACE1ALDH1A1CYP2A6MEN1 | |
| SCHEMBL693087 | 0.72 | ALDH1A1 (0.42) | CYP1A2ALDH1A1CYP2A6MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4668275-A | HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 1987-05-26 | — | — | US | disclosed |