Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.69 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | THPO | P40225 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.35 |
| ▸ | PTPRF | P10586 | 1/20 | 0.35 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.35 |
| ▸ | METAP2 | P50579 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13398637 | 0.83 | KDM4E (0.71) | KDM4ECYP1A2CYP3A4THPOLMNA | |
| SCHEMBL269667 | 0.82 | KDM4E (1.00) | KDM4ECYP1A2CYP3A4THPOLMNA | |
| SCHEMBL1340272 | 0.82 | KDM4E (0.69) | KDM4ECYP1A2CYP3A4THPOLMNA | |
| SCHEMBL985716 | 0.82 | KDM4E (0.69) | KDM4ECYP1A2CYP3A4THPOLMNA | |
| SCHEMBL1338215 | 0.82 | KDM4E (0.69) | KDM4ECYP1A2CYP3A4THPOLMNA | |
| SCHEMBL20376571 | 0.81 | KDM4E (0.72) | KDM4ECYP1A2CYP3A4THPOLMNA | |
| SCHEMBL9588743 | 0.81 | CYP1A2 (0.58) | KDM4ECYP1A2CYP3A4THPOLMNA | |
| SCHEMBL9586887 | 0.80 | KDM4E (0.43) | KDM4ECYP1A2CYP3A4THPOLMNA | |
| SCHEMBL13398664 | 0.78 | KDM4E (0.63) | KDM4ECYP1A2CYP3A4THPOLMNA | |
| SCHEMBL983442 | 0.78 | KDM4E (0.63) | KDM4ELMNAPTPN1NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-5204482-A | Ethylenediamine monoamide heteroaryl derivatives | HOFFMAN-LAROCHE INC. (US) | 1993-04-20 | — | — | US | disclosed |
| US-5011849-A | Monoamine oxidase inhibitors | HOFFMANN-LA ROCHE INC. (US) | 1991-04-30 | — | — | US | disclosed |