Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 6/20 | 0.61 |
| ▸ | ITGAV | P06756 | 6/20 | 0.61 |
| ▸ | THRA | P10827 | 3/20 | 0.35 |
| ▸ | THRB | P10828 | 3/20 | 0.35 |
| ▸ | PPARG | P37231 | 3/20 | 0.35 |
| ▸ | RXRA | P19793 | 2/20 | 0.35 |
| ▸ | PCNA | P12004 | 2/20 | 0.35 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL21064809 | 0.89 | ITGB3 (0.77) | ITGB3ITGAVFOLH1 | |
| SCHEMBL21100942 | 0.84 | ITGB3 (0.70) | ITGB3ITGAVFOLH1 | |
| SCHEMBL21479481 | 0.84 | ITGB3 (0.70) | ITGB3ITGAVTHRATHRBPPARG | |
| SCHEMBL23868262 | 0.77 | ITGB3 (0.71) | ITGB3ITGAV | |
| SCHEMBL19677575 | 0.74 | ITGB3 (0.61) | ITGB3ITGAVTHRATHRBPPARG | |
| SCHEMBL21100766 | 0.74 | ITGB3 (0.64) | ITGB3ITGAV | |
| SCHEMBL19677591 | 0.72 | ITGB3 (0.71) | ITGB3ITGAVTHRATHRBPPARG | |
| SCHEMBL21100765 | 0.71 | ITGB3 (0.60) | ITGB3ITGAV | |
| SCHEMBL21475355 | 0.71 | ITGB3 (0.60) | ITGB3ITGAV | |
| SCHEMBL21100868 | 0.71 | ITGB3 (0.55) | ITGB3ITGAVTHRATHRBPPARG |
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 |
|---|---|---|---|---|---|---|---|
| CN-111971038-B | Compositions and methods for dual targeted treatment of neuroendocrine tumors | 纳米药业有限责任公司 | 2023-11-17 | — | — | CN | disclosed |
| CN-111971038-A | Compositions and methods for dual-targeted treatment of neuroendocrine tumors | 纳米药业有限责任公司 | 2020-11-20 | — | — | CN | disclosed |