Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 10/20 | 0.49 |
| ▸ | DRD3 | P35462 | 10/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | DRD1 | P21728 | 1/20 | 0.45 |
| ▸ | DRD4 | P21917 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4382332 | 0.86 | KDM4E (0.46) | DRD2DRD3KDM4EALDH1A1HPGD | |
| SCHEMBL4381610 | 0.82 | KDM4E (0.44) | DRD2DRD3KDM4EALDH1A1HPGD | |
| SCHEMBL4392626 | 0.81 | DRD3 (0.58) | DRD2DRD3KDM4EALDH1A1HPGD | |
| SCHEMBL4394660 | 0.81 | DRD3 (0.60) | DRD2DRD3KDM4EALDH1A1HPGD | |
| SCHEMBL4385475 | 0.81 | DRD3 (0.60) | DRD2DRD3KDM4EALDH1A1HPGD | |
| SCHEMBL4386303 | 0.77 | DRD3 (0.55) | DRD2DRD3KDM4EALDH1A1HPGD | |
| SCHEMBL4392739 | 0.76 | HTT (0.42) | DRD2DRD3KDM4EALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL7199896 | 0.75 | HTT (0.41) | DRD2DRD3KDM4EALDH1A1HPGD | |
| SCHEMBL4380366 | 0.75 | DRD3 (0.54) | DRD2DRD3KDM4EALDH1A1HPGD | |
| SCHEMBL4380463 | 0.75 | DRD3 (0.55) | DRD2DRD3KDM4EALDH1A1HPGD |
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-1144405-B1 | TRIAZOLE COMPOUNDS WITH DOPAMINE-D3-RECEPTOR AFFINITY | ABBOTT GMBH & CO KG (DE) | 2009-11-25 | — | — | EP | disclosed |
| US-6602867-B1 | Triazole compounds with dopamine-D3-receptor affinity | ABBOTT LABORATORIES | 2003-08-05 | — | — | US | disclosed |