Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | GCK | P35557 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.37 |
| ▸ | ADRB3 | P13945 | 4/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10068784 | 0.95 | MEN1 (0.39) | HTTMEN1MAPTKMT2ALMNA | |
| SCHEMBL10068767 | 0.93 | FAAH (0.43) | MAPTKMT2ASMN1; SMN2ADRB3ALDH1A1 | |
| SCHEMBL10068953 | 0.93 | KLKB1 (0.40) | HTTMEN1MAPTKMT2ALMNA | |
| SCHEMBL10068721 | 0.91 | HTT (0.40) | HTTMEN1MAPTKMT2ALMNA | |
| SCHEMBL10069328 | 0.90 | ADRB3 (0.42) | HTTMEN1MAPTKMT2ALMNA | |
| SCHEMBL10069339 | 0.89 | KDM4E (0.47) | HTTMEN1MAPTKMT2ALMNA | |
| SCHEMBL10068561 | 0.89 | TSHR (0.45) | HTTMEN1MAPTKMT2ALMNA | |
| SCHEMBL10068802 | 0.88 | KLKB1 (0.41) | HTTMEN1MAPTKMT2ALMNA | |
| SCHEMBL10068546 | 0.88 | HTT (0.36) | HTTMEN1MAPTKMT2ALMNA | |
| SCHEMBL2027362 | 0.88 | HTT (0.43) | HTTMEN1MAPTKMT2ALMNA |
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-2012019428-A1 | BENZOHYDROL DERIVATIVES, A PREPARATION PROCESS AND PHARMACEUTICAL USE THEREOF | 上海恒瑞医药有限公司 (CN) | 2012-02-16 | — | — | WO | disclosed |