Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 2/20 | 0.43 |
| ▸ | FUCA1 | P04066 | 2/20 | 0.42 |
| ▸ | TACR3 | P29371 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | GBA1 | P04062 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.39 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.38 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.38 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.38 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.38 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.38 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | MC4R | P32245 | 2/20 | 0.38 |
| ▸ | MC3R | P41968 | 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 | |
|---|---|---|---|---|
| SCHEMBL17542008 | 1.00 | ABCB1 (0.43) | ABCB1FUCA1TACR3MEN1KMT2A | |
| SCHEMBL1189833 | 0.90 | FUCA1 (0.47) | ABCB1FUCA1TACR3MEN1KMT2A | |
| SCHEMBL1189227 | 0.90 | FUCA1 (0.47) | ABCB1FUCA1TACR3MEN1KMT2A | |
| SCHEMBL14692745 | 0.87 | ABCB1 (0.40) | ABCB1FUCA1TACR3MEN1KMT2A | |
| SCHEMBL18577142 | 0.85 | TSHR (0.42) | GAA | |
| Benzene SCHEMBL8581285 | 0.85 | TACR3 (0.51) | ABCB1TACR3GAAMC4RMC3R | |
| SCHEMBL17542526 | 0.85 | ALDH1A1 (0.37) | MEN1KMT2ACYP2C19 | |
| SCHEMBL23459251 | 0.83 | GBA1 (0.43) | TACR3MEN1KMT2AGBA1GAA | |
| SCHEMBL23459412 | 0.83 | GBA1 (0.43) | TACR3MEN1KMT2AGBA1GAA | |
| SCHEMBL23459409 | 0.83 | GBA1 (0.43) | TACR3MEN1KMT2AGBA1GAA |
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-107001259-B | Substituted azetidine derivatives as TAAR ligands | 豪夫迈·罗氏有限公司 | 2019-12-06 | — | — | CN | disclosed |