Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 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 | |
|---|---|---|---|---|
| SCHEMBL9769938 | 0.75 | ALDH1A1 (0.42) | ALDH1A1KDM4EHPGDHTTJAK2 | |
| SCHEMBL7532405 | 0.71 | ALDH1A1 (0.40) | ALDH1A1KDM4EHPGDHTTJAK2 | |
| SCHEMBL11430911 | 0.68 | ALDH1A1 (0.38) | ALDH1A1KDM4EHPGDHTTJAK2 | |
| SCHEMBL11426291 | 0.67 | MAPT (0.40) | ALDH1A1KDM4EHPGDHTTJAK2 | |
| SCHEMBL18784410 | 0.64 | HPGD (0.34) | ALDH1A1KDM4EHPGDHTTJAK2 | |
| SCHEMBL141994 | 0.62 | GSK3A (0.44) | HTTADORA2APOLBPIK3CDADORA3 | |
| SCHEMBL17242241 | 0.62 | KMT2A (0.39) | ALDH1A1KDM4EHPGDHTTJAK2 | |
| SCHEMBL20045954 | 0.59 | KMT2A (0.39) | ALDH1A1KDM4EHPGDHTTJAK2 | |
| SCHEMBL7802796 | 0.59 | KMT2A (0.40) | ALDH1A1KDM4EHPGDHTTJAK2 | |
| SCHEMBL474385 | 0.59 | KMT2A (0.49) | ALDH1A1KDM4EHPGDHTTJAK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1138657-A1 | Process for generating electrophiles from anions by reaction with electrophilic fluorinating agent | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2001-10-04 | — | — | EP | disclosed |
| US-6270843-B1 | REACTING A SALT COMPRISING ANIONIC FORM OF SUBSTITUENT WITH AN ELECTROPHILIC FLUORINATION AGENT TO PROVIDE AN ELECTROPHILE COMPRISING CATIONIC FORM OF SUBSTITUENT; ELECTROPHILICALLY SUBSTITUTING ELECTROPHILE ON SUBSTRATE | AIR PRODUCTS AND CHEMICALS, INC. | 2001-08-07 | — | — | US | disclosed |