Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | IDO1 | P14902 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.44 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3446778 | 0.88 | TDP1 (0.75) | TDP1L3MBTL1TSHRIDO1MAOA | |
| SCHEMBL20534698 | 0.88 | TDP1 (0.75) | TDP1L3MBTL1TSHRIDO1MAOA | |
| SCHEMBL20127257 | 0.86 | IDO1 (0.61) | TDP1L3MBTL1IDO1MAOAHRH3 | |
| SCHEMBL4069939 | 0.84 | TDP1 (0.64) | TDP1L3MBTL1TSHRIDO1HRH3 | |
| SCHEMBL198056 | 0.83 | IDO1 (0.58) | TDP1L3MBTL1IDO1MAOAHRH3 | |
| SCHEMBL14673636 | 0.83 | TSHR (0.50) | TDP1L3MBTL1TSHRIDO1HRH3 | |
| SCHEMBL14673094 | 0.83 | TSHR (0.50) | TDP1L3MBTL1TSHRIDO1HRH3 | |
| Phenol SCHEMBL28176899 | 0.83 | TDP1 (0.64) | TDP1L3MBTL1TSHRIDO1HRH3 | |
| SCHEMBL1568954 | 0.83 | TSHR (0.50) | TDP1L3MBTL1TSHRIDO1MAOA | |
| SCHEMBL7814716 | 0.83 | TSHR (0.50) | TDP1L3MBTL1TSHRHRH3HRH4 |
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 |