Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.65 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.65 |
| ▸ | CA12 | O43570 | 3/20 | 0.65 |
| ▸ | CA1 | P00915 | 3/20 | 0.65 |
| ▸ | CA2 | P00918 | 3/20 | 0.65 |
| ▸ | CA7 | P43166 | 3/20 | 0.65 |
| ▸ | CA9 | Q16790 | 3/20 | 0.65 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.65 |
| ▸ | TSHR | P16473 | 3/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.61 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.61 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.61 |
| ▸ | KDR | P35968 | 1/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.59 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 3/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL1348236 | 0.89 | MAPK1 (0.68) | ESR1ESR2CA12CA1CA2 | |
| SCHEMBL21318094 | 0.88 | ESR1 (0.51) | ESR1ESR2CA12CA1CA2 | |
| SCHEMBL11985743 | 0.86 | MAPK1 (0.59) | ESR1ESR2CA12CA1CA2 | |
| SCHEMBL11987180 | 0.86 | MAPK1 (0.59) | ESR1ESR2CA12CA1CA2 | |
| SCHEMBL235921 | 0.85 | MAPK1 (0.81) | TSHRALDH1A1TDP1SLC6A2MAPK1 | |
| SCHEMBL18652188 | 0.84 | ESR1 (0.62) | ESR1ESR2CA12CA1CA2 | |
| SCHEMBL23484224 | 0.84 | MAPK1 (0.61) | ESR1ESR2CA12CA1CA2 | |
| SCHEMBL1345034 | 0.84 | ESR1 (0.56) | ESR1ESR2CA12CA1CA2 | |
| SCHEMBL6906425 | 0.84 | MAPK1 (0.56) | ESR1ESR2CA12CA1CA2 | |
| SCHEMBL1786754 | 0.84 | MAPK1 (0.79) | TSHRALDH1A1TDP1SLC6A2MAPK1 |
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-0564259-A2 | Stabilized polyurethane foam | ARCO Chemical Technology, L.P. (US) | 1993-10-06 | — | — | EP | claimed |
| EP-0564259-A2 | Stabilized polyurethane foam | ARCO Chemical Technology, L.P. (US) | 1993-10-06 | — | — | EP | disclosed |