Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.39 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP12 | P39900 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 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 | |
|---|---|---|---|---|
| SCHEMBL21623413 | 0.98 | HDAC8 (0.42) | DRD2DRD4DRD3HDAC8CHRNB2 | |
| SCHEMBL21623412 | 0.93 | HDAC8 (0.42) | DRD2DRD4DRD3HDAC8CHRNB2 | |
| SCHEMBL5886568 | 0.90 | FFAR1 (0.51) | CHRNB2CHRNA4FFAR1FFAR4MMP2 | |
| SCHEMBL29187197 | 0.90 | FFAR1 (0.51) | CHRNB2CHRNA4FFAR1FFAR4MMP2 | |
| SCHEMBL1838704 | 0.88 | KDM4E (0.46) | DRD2DRD4DRD3HDAC8CHRNB2 | |
| SCHEMBL7166353 | 0.88 | FFAR1 (0.49) | DRD2DRD4DRD3CHRNB2CHRNA4 | |
| SCHEMBL8428766 | 0.85 | MAPK14 (0.46) | DRD2DRD4DRD3HDAC8CHRNB2 | |
| SCHEMBL13598887 | 0.80 | MAPK14 (0.42) | DRD2DRD4DRD3HDAC8CHRNB2 | |
| SCHEMBL6980856 | 0.80 | MAPK14 (0.43) | DRD2DRD4DRD3HDAC8CHRNB2 | |
| SCHEMBL3044684 | 0.75 | CHRNB2 (0.70) | DRD2DRD4DRD3CHRNB2CHRNA4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020011557-A1 | COORDINATION POLYMER OF A PRECURSOR CONTAINING CU(I) IONS | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2020-01-16 | — | — | WO | disclosed |