Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.40 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2845203 | 0.96 | AKR1C1 (0.45) | ESR1CYP2D6ALDH1A1TSHRAKR1C3 | |
| SCHEMBL4199808 | 0.92 | ESR1 (0.58) | ESR1CYP2D6MAPTKMT2AMEN1 | |
| SCHEMBL7944757 | 0.89 | ALDH1A1 (0.48) | ESR1CYP2D6ALDH1A1TSHRAKR1C3 | |
| SCHEMBL305384 | 0.87 | CYP19A1 (0.50) | CYP2D6ALDH1A1MAPTKMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL9803951 | 0.85 | CYP19A1 (0.49) | CYP2D6ALDH1A1MAPTKMT2AMEN1 | |
| SCHEMBL27808829 | 0.84 | CYP1B1 (0.47) | ALDH1A1AKR1C3MAPTKMT2AMEN1 | |
| SCHEMBL2126763 | 0.83 | CYP1B1 (0.52) | ALDH1A1MAPTKMT2AMEN1POLB | |
| SCHEMBL2992588 | 0.81 | LCK (0.41) | ESR1ALDH1A1TSHRAKR1C3AKR1C1 | |
| SCHEMBL2992590 | 0.81 | LCK (0.41) | ESR1ALDH1A1TSHRAKR1C3AKR1C1 | |
| SCHEMBL18938581 | 0.79 | ALDH1A1 (0.39) | ESR1CYP2D6ALDH1A1TSHRAKR1C3 |
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-6198217-B1 | Organic electroluminescent device having a protective covering comprising organic and inorganic layers | MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) | 2001-03-06 | — | — | US | disclosed |