Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 8/20 | 0.58 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.58 |
| ▸ | HTR1B | P28222 | 2/20 | 0.55 |
| ▸ | HTR1D | P28221 | 1/20 | 0.55 |
| ▸ | ESRRG | P62508 | 1/20 | 0.53 |
| ▸ | ESRRB | O95718 | 2/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL936134 | 0.81 | ESRRB (0.75) | ESR1ESRRGESRRBKDM4EMEN1 | |
| SCHEMBL26775740 | 0.80 | ESR1 (0.64) | ESR1CYP19A1HTR1BHTR1DESRRG | |
| N-Desmethyltamoxifen SCHEMBL17746173 | 0.78 | ESR1 (0.90) | ESR1CYP19A1ESRRGMEN1KMT2A | |
| N-Desmethyltamoxifen SCHEMBL2739189 | 0.78 | ESR1 (0.90) | ESR1CYP19A1ESRRGMEN1KMT2A | |
| N-Desmethyltamoxifen SCHEMBL17164681 | 0.78 | ESR1 (0.90) | ESR1CYP19A1ESRRGMEN1KMT2A | |
| N-Desmethyltamoxifen SCHEMBL29816767 | 0.77 | ESR1 (0.88) | ESR1CYP19A1ESRRGMEN1KMT2A | |
| N-Desmethyltamoxifen SCHEMBL23200481 | 0.76 | ESR1 (0.85) | ESR1CYP19A1ESRRGMEN1KMT2A | |
| SCHEMBL19786407 | 0.76 | ESR1 (0.73) | ESR1CYP19A1HTR1BHTR1DESRRG | |
| SCHEMBL5726917 | 0.76 | ESRRG (0.76) | ESR1CYP19A1HTR1BHTR1DESRRG | |
| SCHEMBL9099885 | 0.76 | ESRRG (0.76) | ESR1CYP19A1HTR1BHTR1DESRRG |
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-2025024525-A1 | SYSTEMS AND METHODS FOR PREDICTING DRUG-INDUCED LIVER INJURY | CELLARITY, INC. (US) | 2025-01-30 | — | — | WO | disclosed |