Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.54 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.31 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.31 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.31 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.31 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL11316392 | 0.75 | CYP1A2 (0.54) | CYP1A2CYP2A6ALDH1A1TSHRKDM4E | |
| SCHEMBL29363045 | 0.74 | CYP1A2 (1.00) | CYP1A2CYP2A6ALDH1A1TSHRKDM4E | |
| SCHEMBL29447796 | 0.74 | CYP1A2 (1.00) | CYP1A2CYP2A6ALDH1A1TSHRKDM4E | |
| SCHEMBL161370 | 0.74 | CYP1A2 (1.00) | CYP1A2CYP2A6ALDH1A1TSHRKDM4E | |
| SCHEMBL9326405 | 0.73 | TSHR (0.43) | CYP1A2CYP2A6ALDH1A1TSHRMAPT | |
| SCHEMBL570484 | 0.70 | CYP1A2 (0.68) | CYP1A2CYP2A6ALDH1A1TSHRKDM4E | |
| SCHEMBL31307958 | 0.70 | CYP1A2 (0.68) | CYP1A2CYP2A6ALDH1A1TSHRKDM4E | |
| SCHEMBL9327630 | 0.70 | CYP1A2 (0.44) | CYP1A2CYP2A6ALDH1A1TSHR | |
| Formaldehyde SCHEMBL3238616 | 0.66 | CYP1A2 (0.81) | CYP1A2CYP2A6ALDH1A1TSHRKDM4E | |
| SCHEMBL21930041 | 0.66 | CYP1A2 (0.81) | CYP1A2CYP2A6ALDH1A1TSHRKDM4E |
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-5283350-A | Aryl esters of phosphonous halides and a process for the preparation thereof | HOECHST AKTIENGESELLSHAFT (DE) | 1994-02-01 | — | — | US | disclosed |