Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 10/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 7/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | AKR1C3 | P42330 | 6/20 | 0.50 |
| ▸ | AKR1C2 | P52895 | 6/20 | 0.50 |
| ▸ | AKR1C1 | Q04828 | 3/20 | 0.50 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.50 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.50 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.47 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.47 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.47 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.47 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.47 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9842518 | 0.97 | APP (0.59) | APPCYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL9842643 | 0.96 | APP (0.58) | APPCYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL9842708 | 0.96 | APP (0.58) | APPCYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL9842360 | 0.96 | APP (0.58) | APPCYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL9842491 | 0.96 | APP (0.58) | APPCYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL9842661 | 0.96 | APP (0.58) | APPCYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL9842477 | 0.94 | APP (0.63) | APPCYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL9842438 | 0.90 | APP (0.65) | APPCYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL9842704 | 0.85 | APP (0.64) | APPCYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL9842609 | 0.84 | APP (0.63) | APPCYP2C9CYP2C19CYP3A4CYP2D6 |
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-0413785-A1 | LIQUID CRYSTALLINE MEDIA CONTAINING FLUORINATED OLIGOPHENYLS. | MERCK PATENT GMBH (DE) | 1991-02-27 | — | — | EP | disclosed |
| WO-1990009420-A1 | LIQUID CRYSTALLINE MEDIA CONTAINING FLUORINATED OLIGOPHENYLS | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1990-08-23 | — | — | WO | disclosed |