Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.52 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.39 |
| ▸ | IKBKB | O14920 | 3/20 | 0.38 |
| ▸ | BRAF | P15056 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | LTA4H | P09960 | 1/20 | 0.37 |
| ▸ | TLR4 | O00206 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.33 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CRHBP | P24387 | 1/20 | 0.33 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9846995 | 0.85 | ESR1 (0.50) | ESR1ESR2CYP3A4CYP2D6TSHR | |
| SCHEMBL9630764 | 0.81 | POLB (0.50) | ESR1ESR2GAACYP3A4 | |
| SCHEMBL9846972 | 0.81 | ESR1 (0.51) | ESR1ESR2GAAALDH1A1CYP3A4 | |
| SCHEMBL25986540 | 0.78 | ESR1 (0.60) | ESR1ESR2GAAALDH1A1LTA4H | |
| SCHEMBL25919777 | 0.78 | ESR1 (0.60) | ESR1ESR2ALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL10000525 | 0.76 | ESR1 (0.66) | ESR1ESR2GAAALDH1A1TSHR | |
| SCHEMBL21798753 | 0.76 | ESR1 (0.70) | ESR1ESR2ALDH1A1TSHRHTT | |
| SCHEMBL827205 | 0.75 | ESR1 (0.69) | ESR1ESR2ALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL9472412 | 0.74 | ESR1 (0.67) | ESR1ESR2ALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL22003016 | 0.73 | ESR1 (0.57) | ESR1ESR2GAAALDH1A1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5496915-A | COPOLYMERS, MELT PROCESSABILITY, HEAT RESISTANCE | BASF AKTIENGESELLSCHAFT (DE) | 1996-03-05 | — | — | US | disclosed |
| EP-0668310-A1 | Polyimide based on diamines with cycloaliphatic moieties | BASF AKTIENGESELLSCHAFT (DE) | 1995-08-23 | — | — | EP | disclosed |