Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 4/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | PKM | P14618 | 2/20 | 0.56 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.56 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | RELA | Q04206 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL144171 | 0.98 | THRB (0.61) | THRBRAB9ANPC1SMN1; SMN2TSHR | |
| SCHEMBL21322109 | 0.93 | THRB (0.56) | THRBRAB9ANPC1SMN1; SMN2TSHR | |
| SCHEMBL12760859 | 0.93 | THRB (0.56) | THRBRAB9ANPC1SMN1; SMN2TSHR | |
| SCHEMBL140660 | 0.93 | THRB (0.56) | THRBRAB9ANPC1SMN1; SMN2TSHR | |
| SCHEMBL17921568 | 0.93 | THRB (0.56) | THRBRAB9ANPC1SMN1; SMN2TSHR | |
| Acetic Acid Propyl Ester SCHEMBL11290042 | 0.91 | THRB (0.54) | THRBRAB9ANPC1SMN1; SMN2TSHR | |
| SCHEMBL8328391 | 0.89 | L3MBTL1 (0.59) | THRBRAB9ANPC1SMN1; SMN2TSHR | |
| Acrylic Acid SCHEMBL28795992 | 0.88 | THRB (0.69) | THRBRAB9ANPC1SMN1; SMN2TSHR | |
| SCHEMBL10030181 | 0.88 | L3MBTL1 (0.55) | THRBRAB9ASMN1; SMN2TSHRPKM | |
| SCHEMBL9151891 | 0.87 | MMP3 (0.55) | THRBRAB9ANPC1SMN1; SMN2PKM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020067800-A1 | INK COMPOSITION FOR ORGANIC LIGHT EMITTING DEVICE | 주식회사 엘지화학 | 2020-04-02 | — | — | WO | disclosed |