Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.48 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | RECQL | P46063 | 2/20 | 0.44 |
| ▸ | APP | P05067 | 4/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | CASP1 | P29466 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19682009 | 0.91 | ESR1 (0.41) | ESR1PDCD1ESR2CD274TSHR | |
| SCHEMBL4668638 | 0.91 | TSHR (0.56) | ESR1PDCD1ESR2CD274TSHR | |
| SCHEMBL170685 | 0.83 | NFKB1 (0.47) | TSHRALDH1A1HSD17B10RECQLAPP | |
| Hydrochloric Acid SCHEMBL2865053 | 0.81 | NFKB1 (0.45) | TSHRALDH1A1APPCA12CA1 | |
| SCHEMBL2495683 | 0.80 | TSHR (0.48) | TSHRALDH1A1HSD17B10RECQLAPP | |
| SCHEMBL24398903 | 0.79 | TSHR (0.42) | TSHRALDH1A1HSD17B10RECQLAPP | |
| SCHEMBL12162477 | 0.79 | TSHR (0.42) | TSHRALDH1A1HSD17B10RECQLAPP | |
| SCHEMBL24490366 | 0.79 | TSHR (0.42) | TSHRALDH1A1HSD17B10RECQLAPP | |
| SCHEMBL20969629 | 0.79 | ADRB2 (0.52) | TSHRALDH1A1HSD17B10RECQLAPP | |
| SCHEMBL24017762 | 0.79 | NOS3 (0.42) | TSHRALDH1A1HSD17B10RECQLAPP |
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-0336391-B1 | Reversibly color-changeable materials | TEIJIN LTD (JP) | 1994-01-26 | — | — | EP | disclosed |
| US-5068062-A | Crosslinked resin containing 4,4*-diaminodiphenylmethane units with the amine quaternized and an electrolytic material | TEIJIN LIMITED (JP) | 1991-11-26 | — | — | US | disclosed |
| EP-0336391-A2 | Reversibly color-changeable materials | TEIJIN LIMITED (JP) | 1989-10-11 | — | — | EP | disclosed |