Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 2/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | HPGDS | O60760 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.33 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | ELANE | P08246 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11344316 | 0.79 | ADRA2A (0.32) | ADRA2AADRA2BADRA2CHDAC1HDAC6 | |
| SCHEMBL31411120 | 0.78 | TSHR (0.46) | ADRA2AADRA2BADRA2CHDAC1HDAC6 | |
| SCHEMBL136966 | 0.78 | TSHR (0.46) | ADRA2AADRA2BADRA2CHDAC1HDAC6 | |
| SCHEMBL1310898 | 0.77 | ADRA2A (0.34) | ADRA2AADRA2BADRA2CHDAC1HDAC6 | |
| SCHEMBL29497438 | 0.76 | KMT2A (0.47) | KMT2ATSHRNPSR1 | |
| SCHEMBL26074401 | 0.76 | ADRA2A (0.36) | ADRA2AADRA2BADRA2CHDAC1HDAC6 | |
| SCHEMBL27428 | 0.76 | KMT2A (0.47) | KMT2ATSHRNPSR1 | |
| SCHEMBL25071165 | 0.76 | KMT2A (0.40) | ADRA2AADRA2BADRA2CHDAC1HDAC6 | |
| SCHEMBL13147546 | 0.74 | KMT2A (0.38) | ADRA2AADRA2BADRA2CHDAC1HDAC6 | |
| SCHEMBL14349289 | 0.74 | KMT2A (0.42) | ADRA2AADRA2BADRA2CHDAC1HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5475112-A | Reducing a substituted trichloromethylpyridine derivative in presence of a proton donor and solvent | ISHIHARA SANGYO KAISHA LTD. (JP) | 1995-12-12 | — | — | US | disclosed |
| EP-0512436-A1 | Method for producing substituted pyridine derivatives | ISHIHARA SANGYO KAISHA, LTD. (JP) | 1992-11-11 | — | — | EP | disclosed |