Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.66 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.66 |
| ▸ | HPGD | P15428 | 1/20 | 0.66 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.42 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.41 |
| ▸ | DHFR | P00374 | 1/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9472324 | 0.84 | APOBEC3G (0.61) | CYP2C9CYP2C19HPGDAPOBEC3GSLC6A4 | |
| SCHEMBL11287076 | 0.81 | APOBEC3G (0.53) | CYP2C9CYP2C19HPGDAPOBEC3GMAPK1 | |
| SCHEMBL26192880 | 0.81 | APOBEC3G (0.53) | CYP2C9CYP2C19HPGDAPOBEC3GSLC6A4 | |
| SCHEMBL27460927 | 0.81 | SLC6A4 (0.65) | CYP2C9CYP2C19HPGDAPOBEC3GSLC6A4 | |
| SCHEMBL1191610 | 0.81 | SLC6A4 (0.63) | CYP2C9CYP2C19HPGDAPOBEC3GCYP3A4 | |
| SCHEMBL8531787 | 0.81 | CYP2C9 (0.49) | CYP2C9CYP2C19HPGDAPOBEC3GSLC6A4 | |
| SCHEMBL4438712 | 0.80 | APOBEC3G (0.52) | CYP2C9CYP2C19HPGDAPOBEC3GSLC6A4 | |
| Hydrochloric Acid SCHEMBL8530226 | 0.80 | CYP2C9 (0.59) | CYP2C9CYP2C19HPGDCYP3A4TSHR | |
| SCHEMBL9814281 | 0.80 | CYP3A4 (0.65) | CYP2C9CYP2C19HPGDAPOBEC3GCYP3A4 | |
| SCHEMBL4442278 | 0.80 | APOBEC3G (0.73) | APOBEC3GMAPK1SLC6A4SLC6A2SLC6A3 |
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-0859757-A1 | DERIVATES OF N,N-DIMETHYL-2-(ARYLTHIO)BENZYLAMINE, THEIR SALTS, METHODS OF PREPARATION AND THEIR USE IN PHARMACEUTICAL MEDICAMENTS | Farmak A.S. (CZ) | 1998-08-26 | — | — | EP | disclosed |
| WO-1997017325-A1 | DERIVATES OF N,N-DIMETHYL-2-(ARYLTHIO)BENZYLAMINE, THEIR SALTS, METHODS OF PREPARATION AND THEIR USE IN PHARMACEUTICAL MEDICAMENTS | FARMAK A.S. (CZ) | 1997-05-15 | — | — | WO | disclosed |