Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4A11 | Q02928 | 7/20 | 0.53 |
| ▸ | CYP4F2 | P78329 | 6/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | PPARA | Q07869 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 4/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.40 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.39 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21787639 | 0.90 | CYP4A11 (0.55) | CYP4A11CYP4F2PTGS2ESR1ESR2 | |
| SCHEMBL7252180 | 0.84 | KMT2A (0.48) | ESR1ESR2CA2CA1CA12 | |
| SCHEMBL3309903 | 0.81 | ESR1 (0.49) | ESR1ESR2CXCR1CXCR2ACACB | |
| SCHEMBL28347595 | 0.81 | PTGS2 (0.62) | CYP4A11CYP4F2PTGS2ESR1ESR2 | |
| SCHEMBL8667512 | 0.80 | CYP4F2 (0.53) | CYP4A11CYP4F2ESR1ESR2 | |
| SCHEMBL18358078 | 0.78 | TSHR (0.42) | ESR1ESR2CXCR1CXCR2 | |
| SCHEMBL8252300 | 0.77 | L3MBTL1 (0.45) | ESR1ESR2 | |
| SCHEMBL14032514 | 0.77 | L3MBTL1 (0.46) | CA2CA1CA12CA9 | |
| SCHEMBL9620180 | 0.77 | SLC6A3 (0.47) | ESR1ESR2 | |
| SCHEMBL1143624 | 0.77 | ESR1 (0.54) | ESR1ESR2CA2CA1CA12 |
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-5852192-A | Cyclic urea derivatives, pharmaceutical compositions containing these compounds and processes for preparing them | DR. KARL THOMAE GMBH (DE) | 1998-12-22 | — | — | US | disclosed |