Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.35 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL507787 | 0.98 | MEN1 (0.40) | ESR1TSHRMEN1KMT2ANPSR1 | |
| SCHEMBL3083071 | 0.98 | MEN1 (0.40) | ESR1TSHRMEN1KMT2ANPSR1 | |
| SCHEMBL6679848 | 0.98 | MEN1 (0.40) | ESR1TSHRMEN1KMT2ANPSR1 | |
| Hydrogen Peroxide SCHEMBL9456481 | 0.95 | CSNK1E (0.43) | TSHRMEN1KMT2ANPSR1CSNK1E | |
| SCHEMBL6683709 | 0.94 | ESR1 (0.42) | ESR1TSHRMEN1KMT2ANPSR1 | |
| SCHEMBL6678854 | 0.88 | TSHR (0.43) | TSHRMEN1KMT2ANPSR1CSNK1E | |
| SCHEMBL6684349 | 0.86 | CSNK1E (0.42) | TSHRMEN1KMT2ANPSR1CSNK1E | |
| SCHEMBL11800593 | 0.86 | ESR1 (0.45) | ESR1TSHROPRM1P2RX7ADRA2A | |
| SCHEMBL7176631 | 0.83 | ESR1 (0.50) | ESR1TSHRNPSR1OPRM1ADRA2A | |
| SCHEMBL9227464 | 0.83 | ESR1 (0.39) | ESR1TSHRNPSR1OPRM1ADRA2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0985649-B1 | Method for producing an aromatic compound having an alkyl group with at least three carbon atoms | TORAY INDUSTRIES (JP) | 2004-11-24 | — | — | EP | disclosed |
| US-6462248-B1 | THROUGH CONVERSION, ISOMERIZATION AND/OR ADSORPTIVE SEPARATION OF AROMATIC COMPOUNDS | TORAY INDUSTRIES, INC. (JP) | 2002-10-08 | — | — | US | disclosed |
| EP-0985649-A2 | Method for producing an aromatic compound having an alkyl group with at least three carbon atoms | TORAY INDUSTRIES, INC. (JP) | 2000-03-15 | — | — | EP | disclosed |