Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 5/20 | 0.83 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.83 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | CA4 | P22748 | 1/20 | 0.52 |
| ▸ | CA6 | P23280 | 1/20 | 0.52 |
| ▸ | IDH1 | O75874 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | THRA | P10827 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | AR | P10275 | 1/20 | 0.44 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.43 |
| ▸ | IGF1R | P08069 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.42 |
| ▸ | CTSB | P07858 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11177663 | 1.00 | ESR1 (0.83) | ESR1ESR2CA1CA2CA4 | |
| SCHEMBL36509 | 0.91 | ESR1 (1.00) | ESR1ESR2CA1CA2CA4 | |
| SCHEMBL29485633 | 0.91 | ESR1 (1.00) | ESR1ESR2CA1CA2CA4 | |
| SCHEMBL29357262 | 0.91 | ESR1 (1.00) | ESR1ESR2CA1CA2CA4 | |
| SCHEMBL8357015 | 0.91 | ESR1 (0.69) | ESR1ESR2CA1CA2CA4 | |
| SCHEMBL27809706 | 0.90 | ESR1 (0.68) | ESR1ESR2IGF1RALOX15KDM4E | |
| SCHEMBL1758368 | 0.88 | ESR1 (0.65) | ESR1ESR2CA1CA2CA4 | |
| SCHEMBL14549314 | 0.88 | ESR1 (0.83) | ESR1ESR2CA1CA2CA4 | |
| SCHEMBL27989541 | 0.86 | ESR2 (0.62) | ESR1ESR2IDH1 | |
| SCHEMBL9450817 | 0.86 | ESR1 (0.80) | ESR1ESR2CA1CA2CA4 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2277936-B1 | Method of preparing polycarbonate resin | LG CHEMICAL LTD (KR) | 2013-03-13 | — | — | EP | disclosed |
| US-6916505-B2 | Mannich based adducts as water based epoxy curing agents with fast cure capabilities for green concrete application | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2005-07-12 | — | — | US | disclosed |
| EP-1454935-B1 | Mannich-based adducts as water based epoxy curing agents with fast cure capabilities for green concrete application | AIR PROD & CHEM (US) | 2005-05-18 | — | — | EP | disclosed |
| US-20040176502-A1 | Water-soluble polyamine adducts | EVONIK OPERATIONS GMBH (DE) | 2004-09-09 | — | — | US | disclosed |
| EP-1454935-A1 | Mannich-based adducts as water based epoxy curing agents with fast cure capabilities for green concrete application | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2004-09-08 | — | — | EP | disclosed |
| US-6342577-B1 | Thermosetting resin compositions useful as underfill sealants | LOCTITE CORPORATION | 2002-01-29 | — | — | US | disclosed |
| US-4197389-A | POLYEPOXIDE-POLYETHER-POLYAMINE REACTION PRODUCT | HOECHST AKTIENGESELLSCHAFT (DE) | 1980-04-08 | — | — | US | disclosed |