Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | CHRNA1 | P02708 | 2/20 | 0.36 |
| ▸ | CHRNG | P07510 | 2/20 | 0.36 |
| ▸ | CHRNB1 | P11230 | 2/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.36 |
| ▸ | CHRND | Q07001 | 2/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19583462 | 0.91 | CHRNA1 (0.33) | CHRNA1CHRNGCHRNB1CHRNB2CHRNB4 | |
| SCHEMBL21060608 | 0.84 | ESR2 (0.32) | CHRNA1CHRNGCHRNB1CHRNB2CHRNB4 | |
| SCHEMBL7115670 | 0.81 | MAOB (0.38) | ACHEMAOBCHRNA1CHRNGCHRNB1 | |
| SCHEMBL6321287 | 0.80 | POLB (0.39) | MAOBCHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL338571 | 0.80 | POLB (0.39) | MAOBCHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL14142902 | 0.79 | KMT2A (0.34) | KMT2A | |
| SCHEMBL10300141 | 0.79 | LTA4H (0.39) | MAOBKMT2A | |
| SCHEMBL19583468 | 0.78 | CYP2A6 (0.35) | LMNAMAOBKMT2APOLBMEN1 | |
| SCHEMBL28530933 | 0.78 | EPHX2 (0.41) | LMNAMAOBTSHRALDH1A1CYP1A2 | |
| SCHEMBL10300138 | 0.78 | HPGD (0.42) | SLC6A2SLC6A3CYP3A4TSHRKMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109705172-B | Heteronuclear metal complexes and process for the preparation of cyclic carbonates catalysed by them | 苏州大学 | 2021-06-22 | — | — | CN | claimed |
| CN-109705172-B | Heteronuclear metal complexes and process for the preparation of cyclic carbonates catalysed by them | 苏州大学 | 2021-06-22 | — | — | CN | disclosed |
| CN-112250608-A | Synthetic method of 2-phenylacetylene selenol compound | 温州医科大学 | 2021-01-22 | — | — | CN | disclosed |