Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | APP | P05067 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | LIPE | Q05469 | 1/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL74678 | 0.84 | MAPT (0.59) | TSHRAPPMAPTL3MBTL1MAPK1 | |
| SCHEMBL17974168 | 0.78 | RXRA (0.53) | TSHRMAPTL3MBTL1MAPK1TDP1 | |
| SCHEMBL29036357 | 0.78 | APP (0.54) | TSHRAPPMAPTL3MBTL1MAPK1 | |
| SCHEMBL6672651 | 0.78 | TSHR (0.50) | TSHRMAPTL3MBTL1MAPK1TDP1 | |
| SCHEMBL23907055 | 0.77 | ALDH1A1 (0.39) | APPMAPTL3MBTL1TDP1LMNA | |
| SCHEMBL8751709 | 0.76 | TSHR (0.64) | TSHRMAPTL3MBTL1LMNACYP1A2 | |
| SCHEMBL3158759 | 0.76 | TSHR (0.64) | TSHRAPPMAPTL3MBTL1HTR1A | |
| SCHEMBL27656865 | 0.75 | FFAR1 (0.49) | APPMAPTL3MBTL1MAPK1TDP1 | |
| SCHEMBL8505929 | 0.75 | LMNA (0.55) | APPMAPTL3MBTL1LMNACYP1A2 | |
| SCHEMBL6830502 | 0.75 | DRD2 (0.50) | TSHRMAPTL3MBTL1MAPK1TDP1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004069774-A2 | SYNTHESIS OF 13C-LABELLED ESTROGEN ANALOGUES | THE UNIVERSITY COURT OF THE UNIVERSITY OF ST ANDREWS (GB) | 2004-08-19 | — | — | WO | disclosed |