Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | TP53 | P04637 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.55 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | TYR | P14679 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | ESR1 | P03372 | 3/20 | 0.50 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL29062899 | 1.00 | TSHR (0.57) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL130709 | 1.00 | TSHR (0.57) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL28450761 | 1.00 | TSHR (0.57) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL29285270 | 1.00 | TSHR (0.57) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL6035520 | 0.97 | TSHR (0.57) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL27533460 | 0.97 | TSHR (0.57) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL9436087 | 0.92 | TSHR (0.60) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL10006039 | 0.92 | TSHR (0.56) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL127366 | 0.90 | CA12 (0.59) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL29029490 | 0.89 | TSHR (0.56) | TSHRALDH1A1LMNATP53CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1328165-B1 | METHOD FOR PREPARING CALCIUM-SUPPLEMENTED BEVERAGES | PEPSICO INC (US) | 2007-10-10 | — | — | EP | claimed |