Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.52 |
| ▸ | ESR1 | P03372 | 7/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | ESRRG | P62508 | 3/20 | 0.49 |
| ▸ | HTR6 | P50406 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.49 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.49 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.49 |
| ▸ | EGFR | P00533 | 1/20 | 0.49 |
| ▸ | GBA1 | P04062 | 1/20 | 0.49 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.49 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.49 |
| ▸ | PRKCG | P05129 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7929087 | 0.89 | CYP2D6 (0.55) | CYP2D6ESR1ESR2MAPTESRRG | |
| SCHEMBL2710225 | 0.89 | CYP2D6 (0.55) | CYP2D6ESR1ESR2MAPTESRRG | |
| SCHEMBL8732737 | 0.89 | CYP2D6 (0.55) | CYP2D6ESR1ESR2MAPTESRRG | |
| SCHEMBL11210480 | 0.84 | ESRRB (0.50) | CYP2D6ESR1ESR2MAPTESRRG | |
| SCHEMBL4543424 | 0.83 | ESR1 (0.59) | CYP2D6ESR1ESR2MAPTESRRG | |
| SCHEMBL28421381 | 0.81 | ESRRG (0.53) | CYP2D6ESR1ESR2MAPTESRRG | |
| SCHEMBL4309222 | 0.81 | CHRNB2 (0.51) | CYP2D6ESR1ESR2MAPTESRRG | |
| SCHEMBL4309220 | 0.81 | CHRNB2 (0.51) | CYP2D6ESR1ESR2MAPTESRRG | |
| SCHEMBL11206983 | 0.80 | L3MBTL1 (0.48) | MAPTMEN1CYP3A4KMT2ANPC1 | |
| SCHEMBL15270396 | 0.80 | CYP2D6 (0.49) | CYP2D6ESR1ESR2MAPTESRRG |
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 |
|---|---|---|---|---|---|---|---|
| US-4996225-A | Antitumor agents | FARMOS GROUP LTD. (FI) | 1991-02-26 | — | — | US | disclosed |