Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 6/20 | 0.45 |
| ▸ | LTA4H | P09960 | 4/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.40 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.40 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL5864089 | 0.93 | EPHX2 (0.43) | ESR1LTA4HEPHX2HTTESR2 | |
| SCHEMBL5863697 | 0.91 | HTT (0.47) | ESR1LTA4HEPHX2HTTESR2 | |
| SCHEMBL5863871 | 0.83 | LTA4H (0.39) | ESR1LTA4HEPHX2HTTKDM4E | |
| SCHEMBL5864009 | 0.69 | MMP1 (0.51) | LTA4HHTTHRH3LMNAKCNH2 | |
| SCHEMBL5864176 | 0.68 | LTA4H (0.58) | ESR1LTA4HEPHX2HTTESR2 | |
| Iodobenzene SCHEMBL8059216 | 0.64 | FAAH (0.48) | LTA4H | |
| SCHEMBL5863941 | 0.64 | HTT (0.49) | ESR1LTA4HEPHX2HTTESR2 | |
| SCHEMBL876980 | 0.64 | LTA4H (0.75) | LTA4HPSMB1PSMB5PSMB2HRH3 | |
| SCHEMBL5943719 | 0.64 | LTA4H (0.83) | LTA4HHTTPSMB1PSMB5PSMB2 | |
| SCHEMBL7134882 | 0.64 | LTA4H (1.00) | LTA4HHTTPSMB1PSMB5PSMB2 |
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-1542967-A1 | AMIDE AND SULFONAMIDE LIGANDS FOR THE ESTROGEN RECEPTOR | Pfizer Products Inc. (US) | 2005-06-22 | — | — | EP | disclosed |
| WO-2004026823-A1 | AMIDE AND SULFONAMIDE LIGANDS FOR THE ESTROGEN RECEPTOR | PFIZER PRODUCTS INC. (US) | 2004-04-01 | — | — | WO | disclosed |