Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 2/20 | 0.44 |
| ▸ | DRD2 | P14416 | 3/20 | 0.41 |
| ▸ | DRD3 | P35462 | 3/20 | 0.41 |
| ▸ | DRD4 | P21917 | 2/20 | 0.41 |
| ▸ | HRH2 | P25021 | 2/20 | 0.41 |
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3693463 | 1.00 | PTPN1 (0.44) | PTPN1DRD2DRD3DRD4HRH2 | |
| SCHEMBL3685244 | 0.97 | PTPN1 (0.43) | PTPN1DRD2DRD3DRD4HRH2 | |
| SCHEMBL3686258 | 0.97 | PTPN1 (0.43) | PTPN1DRD2DRD3DRD4HRH2 | |
| SCHEMBL3691194 | 0.91 | PTPN1 (0.41) | PTPN1DRD2DRD3DRD4HRH2 | |
| SCHEMBL3693464 | 0.91 | PTPN1 (0.43) | PTPN1DRD2DRD3DRD4HRH2 | |
| SCHEMBL3684550 | 0.91 | PTPN1 (0.41) | PTPN1DRD2DRD3DRD4HRH2 | |
| SCHEMBL3686127 | 0.90 | PTPN1 (0.41) | PTPN1DRD2DRD3DRD4HRH2 | |
| SCHEMBL3685873 | 0.90 | PTPN1 (0.41) | PTPN1DRD2DRD3DRD4HRH2 | |
| SCHEMBL3685247 | 0.87 | ALDH1A1 (0.43) | PTPN1DRD2DRD3DRD4HRH2 | |
| SCHEMBL3681834 | 0.87 | HDAC3 (0.46) | PTPN1ALDH1A1LMNASMN1; SMN2HTR7 |
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-7642367-B2 | Diamino-functional chalcones | LICA PHARMACEUTICALS A/S (DK) | 2010-01-05 | — | — | US | disclosed |
| US-20060235073-A1 | Diamino-functional chalcones | LICA PHARMACEUTICALS A/S (DK) | 2006-10-19 | — | — | US | disclosed |