Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 6/20 | 0.40 |
| ▸ | DRD3 | P35462 | 6/20 | 0.40 |
| ▸ | CASR | P41180 | 7/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | HPGDS | O60760 | 2/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.37 |
| ▸ | ITGAV | P06756 | 1/20 | 0.37 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.37 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6799964 | 0.95 | DRD2 (0.39) | ALDH1A1GFERDRD2DRD3CASR | |
| SCHEMBL6800155 | 0.91 | ALDH1A1 (0.44) | ALDH1A1GFERDRD2DRD3CASR | |
| SCHEMBL6797582 | 0.87 | ITGB3 (0.41) | ALDH1A1DRD3ITGB3ITGAVITGA2B | |
| SCHEMBL381765 | 0.87 | ALDH1A1 (0.46) | ALDH1A1GFERDRD2DRD3CASR | |
| SCHEMBL7540512 | 0.86 | DRD2 (0.41) | ALDH1A1GFERDRD2DRD3CASR | |
| SCHEMBL7539445 | 0.84 | CNR1 (0.44) | ALDH1A1GFERDRD2DRD3CASR | |
| SCHEMBL382963 | 0.83 | SMYD3 (0.43) | ALDH1A1GFERDRD2DRD3CASR | |
| SCHEMBL6799962 | 0.82 | CASR (0.40) | ALDH1A1GFERDRD2DRD3CASR | |
| SCHEMBL6801434 | 0.80 | ITGB3 (0.43) | DRD2DRD3CASRHPGDSCNR1 | |
| SCHEMBL7544324 | 0.78 | ITGB3 (0.42) | ALDH1A1ITGB3ITGAVITGA2B |
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-6750219-B1 | HAVING INTEGRIN ALPHA V BETA 3 ANTAGONISTIC ACTIVITY, GP IIB/IIIA ANTAGONISTIC ACTIVITY, AND/OR HUMAN PLATELET AGGREGATION INHIBITORY ACTIVITY AND ALSO HAVING EXCELLENT WATER SOLUBILITY | MEIJI SEIKA KAISHA, LTD. (JP) | 2004-06-15 | — | — | US | claimed |
| US-6750219-B1 | HAVING INTEGRIN ALPHA V BETA 3 ANTAGONISTIC ACTIVITY, GP IIB/IIIA ANTAGONISTIC ACTIVITY, AND/OR HUMAN PLATELET AGGREGATION INHIBITORY ACTIVITY AND ALSO HAVING EXCELLENT WATER SOLUBILITY | MEIJI SEIKA KAISHA, LTD. (JP) | 2004-06-15 | — | — | US | disclosed |