Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 4/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | THPO | P40225 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | FEN1 | P39748 | 1/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8959266 | 0.95 | KCNH2 (0.50) | KCNH2TSHRCYP2C19LMNACYP2D6 | |
| SCHEMBL8959251 | 0.87 | TTR (0.40) | KCNH2TSHRCYP2C19LMNACYP2D6 | |
| SCHEMBL8959272 | 0.82 | HTT (0.42) | KCNH2TSHRCYP2C19LMNACYP2D6 | |
| SCHEMBL8959209 | 0.82 | KCNH2 (0.43) | KCNH2TSHRCYP2C19LMNACYP2D6 | |
| SCHEMBL331085 | 0.80 | HTT (0.52) | KCNH2TSHRCYP2C19LMNACYP2D6 | |
| SCHEMBL14927 | 0.79 | LDHA (0.41) | HTTMEN1TP53CYP1A2KMT2A | |
| SCHEMBL9151069 | 0.79 | NSD2 (0.39) | TSHRHTTCYP3A4MEN1TP53 | |
| SCHEMBL8664739 | 0.78 | SLC22A1 (0.44) | KCNH2TSHRCYP2C19LMNACYP2D6 | |
| Hydrochloric Acid SCHEMBL28523486 | 0.78 | LDHA (0.40) | HTTMEN1TP53CYP1A2KMT2A | |
| SCHEMBL9503533 | 0.77 | NSD2 (0.38) | TSHRHTTCYP3A4MEN1TP53 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5545502-A | CONTAINING SPECIFIED QUATERNARY AMMONIUM SALT AS CHARGE CONTROL AGENT | MITSUBISHI CHEMICAL CORPORATION (JP) | 1996-08-13 | — | — | US | disclosed |
| EP-0602566-B1 | Electrostatic image-developing toner | MITSUBISHI CHEM CORP (JP) | 1996-07-31 | — | — | EP | disclosed |
| EP-0602566-A1 | Electrostatic image-developing toner | Mitsubishi Chemical Corporation (JP) | 1994-06-22 | — | — | EP | disclosed |