Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 5/20 | 0.44 |
| ▸ | HTR2C | P28335 | 5/20 | 0.44 |
| ▸ | HTR2B | P41595 | 4/20 | 0.44 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | AADAT | Q8N5Z0 | 2/20 | 0.35 |
| ▸ | GOT1 | P17174 | 1/20 | 0.35 |
| ▸ | KYAT1 | Q16773 | 1/20 | 0.35 |
| ▸ | KYAT3 | Q6YP21 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22292629 | 0.80 | NOTUM (0.53) | HTR2AHTR2CHTR2BNOTUMLMNA | |
| SCHEMBL21172724 | 0.78 | NOTUM (0.43) | HTR2AHTR2CHTR2BNOTUMADRA2A | |
| SCHEMBL21172504 | 0.78 | NOTUM (0.43) | HTR2AHTR2CHTR2BNOTUMADRA2A | |
| SCHEMBL787596 | 0.78 | NOTUM (0.43) | HTR2AHTR2CHTR2BNOTUMADRA2A | |
| SCHEMBL28217735 | 0.77 | NOTUM (0.42) | HTR2AHTR2CHTR2BNOTUMADRA2A | |
| SCHEMBL17264305 | 0.74 | CHRM2 (0.42) | HTR2AHTR2CHTR2BNOTUMKMT2A | |
| SCHEMBL17264304 | 0.74 | CHRM2 (0.42) | HTR2AHTR2CHTR2BNOTUMKMT2A | |
| SCHEMBL18540658 | 0.73 | HTR2A (0.44) | HTR2AHTR2CHTR2BNOTUMADRA2A | |
| SCHEMBL21172695 | 0.72 | NOTUM (0.41) | HTR2AHTR2CHTR2BNOTUMADRA2A | |
| SCHEMBL12340979 | 0.72 | NOTUM (0.41) | HTR2AHTR2CHTR2BNOTUMADRA2A |
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-105189461-B | The dibasic 1- acyl groups -4- amino -1,2,3,4- tetrahydroquinoline derivatives of 2,3- and their purposes as bromine domain inhibitor | 葛兰素史克知识产权第二有限公司 | 2018-05-15 | — | — | CN | disclosed |