Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | SLC6A1 | P30531 | 2/20 | 0.33 |
| ▸ | SLC6A11 | P48066 | 1/20 | 0.33 |
| ▸ | GABRP | O00591 | 1/20 | 0.33 |
| ▸ | GABRD | O14764 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Pyrrolidine SCHEMBL29060582 | 0.92 | LMNA (0.56) | LMNASMN1; SMN2CXCR4ALOX15HSD17B10 | |
| Piperazine SCHEMBL30007068 | 0.92 | LMNA (0.62) | LMNASMN1; SMN2CXCR4ALOX15HSD17B10 | |
| Piperazine SCHEMBL28153791 | 0.92 | LMNA (0.62) | LMNASMN1; SMN2CXCR4ALOX15HSD17B10 | |
| Piperidine SCHEMBL4407343 | 0.90 | LMNA (0.53) | LMNASMN1; SMN2CXCR4ALOX15HSD17B10 | |
| Acrylic Acid SCHEMBL9592581 | 0.89 | — | — | |
| Acrylic Acid SCHEMBL11121509 | 0.87 | LMNA (0.50) | LMNASMN1; SMN2CXCR4ALOX15HSD17B10 | |
| Piperazine SCHEMBL28454920 | 0.82 | LMNA (0.50) | LMNAALOX15HSD17B10TSHRALDH1A1 | |
| Acrylic Acid SCHEMBL11118606 | 0.81 | LMNA (0.56) | LMNAALOX15HSD17B10TSHRALDH1A1 | |
| Bicarbonate SCHEMBL16668464 | 0.80 | CXCR4 (0.64) | LMNASMN1; SMN2CXCR4TSHRALDH1A1 | |
| Piperidine SCHEMBL23420619 | 0.80 | LMNA (0.42) | LMNASMN1; SMN2ALOX15HSD17B10TSHR |
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-6297191-B1 | SOLID SUBSTRATE, LINKER AND METAL CHELATE CROWN ETHER, AN OXA-AZA CROWN ETHER, A THIA-AZA CROWN ETHER, A THIA-OXO CROWN ETHER, A THIA-CROWN ETHER | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY | 2001-10-02 | — | — | US | disclosed |
| US-6077421-A | Metal complexing | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2000-06-20 | — | — | US | disclosed |