Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 6/20 | 0.50 |
| ▸ | DRD2 | P14416 | 6/20 | 0.50 |
| ▸ | DRD3 | P35462 | 6/20 | 0.50 |
| ▸ | HTR1A | P08908 | 4/20 | 0.50 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7393808 | 0.92 | ADRA1D (0.50) | DRD4DRD2DRD3HTR1AADRA1D | |
| SCHEMBL7387650 | 0.85 | HTR1A (0.53) | DRD4DRD2DRD3HTR1AADRA1D | |
| SCHEMBL7388676 | 0.85 | MEN1 (0.58) | DRD4DRD2DRD3HTR1AADRA1D | |
| SCHEMBL7392588 | 0.85 | HTR1A (0.53) | DRD4DRD2DRD3HTR1AKDM4E | |
| SCHEMBL7392808 | 0.85 | HTR1A (0.47) | DRD4DRD2DRD3HTR1AKDM4E | |
| SCHEMBL7387837 | 0.85 | HTR1A (0.47) | DRD4DRD2DRD3HTR1AKDM4E | |
| SCHEMBL7389068 | 0.83 | HTR1A (0.48) | DRD4DRD2DRD3HTR1AKDM4E | |
| SCHEMBL7392006 | 0.83 | DRD4 (0.60) | DRD4DRD2DRD3HTR1AADRA1D | |
| SCHEMBL7396125 | 0.83 | DRD4 (0.53) | DRD4DRD2DRD3ADRA1DADRA1A | |
| SCHEMBL7385781 | 0.82 | HTR1A (0.47) | DRD4DRD2DRD3HTR1AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-1246319-C | Amino (thio) ether derivative | MERCK PATENT AG (DE) | 2006-03-22 | — | — | CN | disclosed |
| EP-1123933-A1 | 2-[5-(4-fluorophenyl)-3-pyridylmethylaminomethyl]chromane as CNS active agent | MERCK PATENT GmbH (DE) | 2001-08-16 | — | — | EP | disclosed |
| EP-0707007-A1 | Amino(thio)ether derivatives as CNS active agents | MERCK PATENT GmbH (DE) | 1996-04-17 | — | — | EP | disclosed |