Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 2/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 6/20 | 0.47 |
| ▸ | BCHE | P06276 | 2/20 | 0.47 |
| ▸ | ACHE | P22303 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.41 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9098371 | 0.87 | LTA4H (0.56) | LTA4HHRH3MAOBBCHEACHE | |
| SCHEMBL10887640 | 0.86 | HRH3 (0.64) | LTA4HHRH3MAOBBCHEACHE | |
| SCHEMBL9098520 | 0.81 | HRH3 (0.56) | LTA4HHRH3BCHEACHEKCNH2 | |
| SCHEMBL19644189 | 0.76 | CYP2D6 (0.60) | LTA4HHRH3BCHEACHECYP2D6 | |
| SCHEMBL11253539 | 0.75 | LTA4H (0.81) | LTA4HHRH3CYP2D6KCNH2TSHR | |
| SCHEMBL10955550 | 0.73 | LTA4H (0.54) | LTA4HHRH3MAOBBCHEACHE | |
| SCHEMBL16784200 | 0.72 | TRPA1 (0.59) | LTA4HMAOBTSHR | |
| SCHEMBL31197199 | 0.72 | TRPA1 (0.59) | LTA4HMAOBTSHR | |
| SCHEMBL14174799 | 0.72 | HRH3 (0.61) | LTA4HHRH3MAOBBCHEACHE | |
| SCHEMBL31197198 | 0.71 | TLR4 (0.46) | LTA4HTSHRS1PR1S1PR3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0260066-B1 | TAMOXIFEN DERIVATIVES | NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) | 1990-05-09 | — | — | EP | disclosed |
| US-4839155-A | Iodotamoxifen derivatives and use for estrogen receptor-positive breast cancer detection and therapy | NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) | 1989-06-13 | — | — | US | disclosed |
| EP-0260066-A1 | Tamoxifen derivatives | NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) | 1988-03-16 | — | — | EP | disclosed |