Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 16/20 | 0.51 |
| ▸ | ESR2 | Q92731 | 13/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.41 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.41 |
| ▸ | PSMB2 | P49721 | 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 | |
|---|---|---|---|---|
| SCHEMBL2475993 | 0.72 | ESR1 (0.75) | ESR1ESR2HRH3LTA4HKDM4E | |
| SCHEMBL699174 | 0.70 | ESR1 (0.76) | ESR1ESR2HRH3LTA4HKDM4E | |
| SCHEMBL1359959 | 0.70 | ESR1 (0.76) | ESR1ESR2HRH3LTA4HKDM4E | |
| SCHEMBL13649149 | 0.69 | ESR1 (0.70) | ESR1ESR2HRH3LTA4HKDM4E | |
| SCHEMBL9075655 | 0.69 | ESR1 (0.61) | ESR1ESR2HRH3LTA4H | |
| SCHEMBL5649675 | 0.66 | PSMB1 (0.82) | ESR1ESR2HRH3LTA4HPSMB1 | |
| SCHEMBL5253017 | 0.65 | PSMB1 (0.45) | HRH3LTA4HTDP1PSMB1PSMB5 | |
| SCHEMBL6847587 | 0.65 | ESR1 (0.52) | ESR1ESR2MEN1KMT2AHRH3 | |
| SCHEMBL14767387 | 0.65 | ESR1 (0.63) | ESR1ESR2HRH3LTA4HKDM4E | |
| SCHEMBL14767389 | 0.65 | ESR1 (0.60) | ESR1ESR2HRH3LTA4HKDM4E |
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-1401446-A1 | TETRAHYDROQUINOLIN DERIVATIVES FOR THE INHIBITION OF DISEASES ASSOCIATED WITH ESTROGEN DEPRIVATION OR WITH AN ABERRANT PHYSIOLOGICAL RESPONSE TO ENDOGENOUS ESTROGEN | ELI LILLY AND COMPANY (US) | 2004-03-31 | — | — | EP | claimed |
| WO-2002094268-A1 | TETRAHYDROQUINOLIN DERIVATIVES FOR THE INHIBITION OF DISEASES ASSOCIATED WITH ESTROGEN DEPRIVATION OR WITH AN ABERRANT PHYSIOLOGICAL RESPONSE TO ENDOGENOUS ESTROGEN | ELI LILLY AND COMPANY (US) | 2002-11-28 | — | — | WO | claimed |