Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALB | P02768 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.38 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.38 |
| ▸ | SELL | P14151 | 1/20 | 0.35 |
| ▸ | SELP | P16109 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TTR | P02766 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.32 |
| ▸ | STAT3 | P40763 | 1/20 | 0.32 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1834310 | 0.81 | CA12 (0.41) | CA1CA12CA9SELLSELP | |
| SCHEMBL317655 | 0.79 | ALB (0.49) | ALBCA1CA12CA9AKR1C2 | |
| SCHEMBL20837977 | 0.72 | CA12 (0.42) | CA1CA12CA9CYP1A2KMT2A | |
| SCHEMBL4432972 | 0.71 | ALDH1A1 (0.40) | CA1CA12CA9SELLSELP | |
| SCHEMBL13315472 | 0.70 | ALB (0.65) | ALBCA1CA12CA9AKR1C2 | |
| SCHEMBL6828586 | 0.70 | ALB (0.53) | ALBCA1AKR1C2AKR1C1SELL | |
| SCHEMBL31455903 | 0.69 | ALB (0.57) | ALBCA1CA12CA9AKR1C2 | |
| SCHEMBL7880433 | 0.69 | ALB (0.57) | ALBCA1CA12CA9AKR1C2 | |
| SCHEMBL31653832 | 0.69 | KEAP1 (0.43) | ALBCA1CA12CA9TSHR | |
| SCHEMBL317703 | 0.69 | KEAP1 (0.43) | ALBCA1CA12CA9TSHR |
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-2318366-A2 | PSMA-BINDING AGENTS AND USES THEREOF | The Johns Hopkins University (US) | 2011-05-11 | — | — | EP | disclosed |
| WO-2010014933-A2 | PSMA-BINDING AGENTS AND USES THEREOF | THE JOHNS HOPKINS UNIVERSITY (US) | 2010-02-04 | — | — | WO | disclosed |