Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL696352 | 0.97 | THRB (0.56) | THRBTDP1L3MBTL1ALDH1A1BRPF1 | |
| SCHEMBL1647027 | 0.83 | THRB (0.74) | THRBALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL10395098 | 0.83 | THRB (0.48) | THRBTDP1L3MBTL1ALDH1A1BRPF1 | |
| SCHEMBL1669167 | 0.83 | THRB (0.48) | THRBTDP1L3MBTL1ALDH1A1BRPF1 | |
| SCHEMBL12160758 | 0.81 | CES2 (0.54) | THRBTDP1L3MBTL1LMNAACHE | |
| SCHEMBL5724714 | 0.81 | THRB (0.46) | THRBTDP1L3MBTL1ALDH1A1BRPF1 | |
| SCHEMBL30590428 | 0.81 | CD44 (0.48) | THRBTDP1L3MBTL1ALDH1A1BRPF1 | |
| SCHEMBL28190197 | 0.81 | THRB (0.46) | THRBTDP1L3MBTL1ALDH1A1BRPF1 | |
| SCHEMBL4058388 | 0.81 | CD44 (0.48) | THRBTDP1L3MBTL1ALDH1A1BRPF1 | |
| SCHEMBL13100052 | 0.81 | ALDH1A1 (0.52) | THRBALDH1A1HPGDPKMNPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105315170-B | Dimethyl benzene ammonium long-chain compound, preparation, self-assembly structure and application | 四川大学华西医院 | 2017-08-25 | — | — | CN | claimed |
| CN-105315170-B | Dimethyl benzene ammonium long-chain compound, preparation, self-assembly structure and application | 四川大学华西医院 | 2017-08-25 | — | — | CN | disclosed |