Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.35 |
| ▸ | CECR2 | Q9BXF3 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4372909 | 0.98 | TSHR (0.51) | TSHRHTTKMT2ALMNABLM | |
| Caprolactam SCHEMBL28605087 | 0.85 | TSHR (0.40) | TSHRHTTKMT2ALMNABLM | |
| SCHEMBL16527290 | 0.83 | HTT (0.55) | TSHRHTTKMT2ALMNABLM | |
| SCHEMBL27908584 | 0.81 | TSHR (0.36) | TSHRHTTKMT2ALMNAALDH1A1 | |
| SCHEMBL11760214 | 0.77 | TSHR (0.59) | TSHRHTTKMT2ALMNABLM | |
| SCHEMBL28167209 | 0.76 | TSHR (0.50) | TSHRHTTKMT2ALMNABLM | |
| SCHEMBL898823 | 0.73 | TSHR (0.39) | TSHRHTTKMT2ALMNAPIK3CD | |
| SCHEMBL3103825 | 0.73 | TSHR (0.39) | TSHRHTTKMT2ALMNABLM | |
| SCHEMBL917410 | 0.73 | TSHR (0.58) | TSHRHTTKMT2ALMNAPIK3CD | |
| SCHEMBL8607333 | 0.73 | LMNA (0.44) | TSHRKMT2ALMNABLMPOLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-110055140-A | It is a kind of to replace aqueous cleaning multiple-effect agent for carbon hydrogen detergent and preparation method thereof | 马鞍山华之杰金属表面处理剂有限公司 | 2019-07-26 | — | — | CN | disclosed |