Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 10/20 | 0.53 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.53 |
| ▸ | ESRRG | P62508 | 5/20 | 0.53 |
| ▸ | PSMB1 | P20618 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | TP53 | P04637 | 3/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | PSMB5 | P28074 | 3/20 | 0.53 |
| ▸ | PGR | P06401 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.53 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.53 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.53 |
| ▸ | EGFR | P00533 | 1/20 | 0.53 |
| ▸ | GBA1 | P04062 | 1/20 | 0.53 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL9857099 | 0.89 | ESR1 (0.52) | ESR1ESR2ESRRGPSMB1MAPT | |
| SCHEMBL9857608 | 0.89 | ESR1 (0.52) | ESR1ESR2ESRRGPSMB1MAPT | |
| SCHEMBL9857688 | 0.88 | ESR1 (0.65) | ESR1ESR2ESRRGPSMB1MAPT | |
| SCHEMBL9857666 | 0.88 | ESR1 (0.65) | ESR1ESR2ESRRGPSMB1MAPT | |
| SCHEMBL9857681 | 0.83 | ESR1 (0.63) | ESR1ESR2ESRRGPSMB1MAPT | |
| SCHEMBL9857672 | 0.83 | ESR1 (0.63) | ESR1ESR2ESRRGPSMB1MAPT | |
| SCHEMBL10697675 | 0.82 | HRH3 (0.42) | ESR1ESRRGMEN1KMT2ASLC6A4 | |
| Piperidine SCHEMBL9857872 | 0.80 | ESR1 (0.54) | ESR1ESR2ESRRGPSMB1MAPT | |
| SCHEMBL10403690 | 0.80 | ESR1 (0.67) | ESR1ESR2ESRRGPSMB1MAPT | |
| SCHEMBL9857874 | 0.79 | ESR1 (0.81) | ESR1ESR2ESRRGPSMB1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0272330-B1 | 1,1,2-TRIARYL-1-BUTENE DERIVATIVES | TAIHO PHARMACEUTICAL COMPANY LIMITED (JP) | 1991-05-22 | — | — | EP | disclosed |
| US-4897503-A | ANTITUMOR AGENTS; TREATING MAMMARY CANCER AND ANOVULATORY INFERTILITY | TAIHO PHARMACEUTICAL (JP) | 1990-01-30 | — | — | US | disclosed |