Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.62 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.62 |
| ▸ | CA12 | O43570 | 2/20 | 0.62 |
| ▸ | CA1 | P00915 | 2/20 | 0.62 |
| ▸ | CA2 | P00918 | 2/20 | 0.62 |
| ▸ | CA7 | P43166 | 2/20 | 0.62 |
| ▸ | CA9 | Q16790 | 2/20 | 0.62 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.62 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 4/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | TSHR | P16473 | 3/20 | 0.54 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.54 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.54 |
| ▸ | KDR | P35968 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL6665500 | 0.95 | ESR1 (0.53) | ESR1ESR2CA12CA1CA2 | |
| SCHEMBL3628980 | 0.81 | ESR1 (0.61) | ESR1ESR2CA12CA1CA2 | |
| SCHEMBL6667803 | 0.79 | TSHR (0.46) | CA12CA1CA2CA7CA9 | |
| Ethylparaben SCHEMBL28326875 | 0.78 | ESR1 (0.92) | ESR1ESR2CA12CA1CA2 | |
| SCHEMBL6394260 | 0.78 | ESR1 (0.56) | ESR1ESR2CA12CA1CA2 | |
| Ethylparaben SCHEMBL5311680 | 0.77 | CA12 (1.00) | ESR1ESR2CA12CA1CA2 | |
| Ethylparaben SCHEMBL28368 | 0.77 | CA12 (1.00) | ESR1ESR2CA12CA1CA2 | |
| SCHEMBL10719857 | 0.76 | ESR1 (0.50) | ESR1ESR2CA12CA1CA2 | |
| Ethylparaben SCHEMBL23497074 | 0.76 | CA12 (0.96) | ESR1ESR2CA12CA1CA2 | |
| Ethylparaben SCHEMBL475792 | 0.76 | CA12 (0.96) | ESR1ESR2CA12CA1CA2 |
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-6783948-B1 | USED IN DIAGNOSTIC IMMUNOASSAYS; HAS DISTINCTLY DIFFERENT LIGHT EMISSION CHARACTERISTICS (EMISSION WAVELENGTH, KINETICS, OR QUANTUM YIELD) | BAYER CORPORATION | 2004-08-31 | — | — | US | disclosed |