Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.40 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.30 |
| ▸ | CHRNG | P07510 | 1/20 | 0.30 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.30 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.30 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.30 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.30 |
| ▸ | CHRND | Q07001 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20540884 | 0.67 | HSD11B1 (0.46) | HSD11B1 | |
| 1,4-Dichlorobenzene SCHEMBL11243685 | 0.63 | — | — | |
| 1,4-Dichlorobenzene SCHEMBL5191 | 0.63 | — | — | |
| SCHEMBL25405882 | 0.63 | CES2 (0.46) | LMNA | |
| SCHEMBL25404658 | 0.63 | ADRB2 (0.43) | MAOAMAOBLMNACYP2A6SLC6A4 | |
| SCHEMBL11786907 | 0.62 | MAOA (0.52) | MAOAMAOBLMNACYP2A6KDM1A | |
| SCHEMBL10362472 | 0.60 | SLC6A3 (0.41) | MAOAMAOBLMNACYP2A6KDM1A | |
| SCHEMBL4778396 | 0.60 | LMNA (0.40) | MAOAMAOBLMNACYP2A6KDM1A | |
| SCHEMBL9735920 | 0.60 | CCNB2 (0.47) | MAOAMAOBLMNACYP2A6KDM1A | |
| 1,4-Dichlorobenzene SCHEMBL10603593 | 0.60 | — | — |
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-112955437-A | Compounds useful in organic electronic devices | 默克专利有限公司 | 2021-06-11 | — | — | CN | disclosed |