Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 7/20 | 0.70 |
| ▸ | PSMB1 | P20618 | 9/20 | 0.60 |
| ▸ | PSMB5 | P28074 | 8/20 | 0.60 |
| ▸ | PSMB2 | P49721 | 4/20 | 0.60 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.54 |
| ▸ | PDE1A | P54750 | 2/20 | 0.54 |
| ▸ | PDE1B | Q01064 | 2/20 | 0.54 |
| ▸ | PDE1C | Q14123 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.52 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.52 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.52 |
| ▸ | EGFR | P00533 | 1/20 | 0.52 |
| ▸ | GBA1 | P04062 | 1/20 | 0.52 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.52 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | PRKCG | P05129 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL7603635 | 0.89 | ESR1 (0.88) | ESR1PSMB1PSMB5PSMB2ESR2 | |
| SCHEMBL7597039 | 0.88 | ESR1 (0.89) | ESR1PSMB1PSMB5PSMB2ESR2 | |
| SCHEMBL7602293 | 0.84 | ESR1 (0.65) | ESR1PSMB1PSMB5ESR2MAPT | |
| SCHEMBL7597053 | 0.83 | ESR1 (0.68) | ESR1PSMB1PSMB5ESR2PDE1A | |
| SCHEMBL7598246 | 0.83 | ESR1 (1.00) | ESR1PSMB1PSMB5PSMB2ESR2 | |
| SCHEMBL7598249 | 0.83 | ESR1 (1.00) | ESR1PSMB1PSMB5PSMB2ESR2 | |
| SCHEMBL23266951 | 0.80 | PSMB1 (0.87) | ESR1PSMB1PSMB5PSMB2ESR2 | |
| SCHEMBL7601189 | 0.79 | ESR1 (0.74) | ESR1PSMB1PSMB5PSMB2ESR2 | |
| SCHEMBL7602726 | 0.78 | ESR1 (0.72) | ESR1PSMB1PSMB5ESR2MAPT | |
| SCHEMBL7602724 | 0.78 | ESR1 (0.72) | ESR1PSMB1PSMB5ESR2MAPT |
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-2002066415-A2 | NON-STEROIDAL MODULATORS OF ESTROGEN RECEPTORS | THE PROVOST, FELLOWS AND SCHOLARS OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABETH NEAR DUBLIN (IE) | 2002-08-29 | — | — | WO | claimed |