Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.62 |
| ▸ | BCHE | P06276 | 1/20 | 0.54 |
| ▸ | ACHE | P22303 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | ABCG2 | Q9UNQ0 | 5/20 | 0.50 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.50 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.50 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | KIF11 | P52732 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL30740857 | 0.88 | POLB (0.52) | LMNAPOLBMEN1KMT2AMAPT | |
| SCHEMBL8372051 | 0.87 | LMNA (0.69) | LMNABCHEACHEPOLBMEN1 | |
| SCHEMBL23438776 | 0.86 | PKM (0.53) | LMNAPOLBMEN1KMT2AMAPT | |
| SCHEMBL15511617 | 0.85 | ABCG2 (0.67) | LMNAABCG2ABCB1KIF11 | |
| SCHEMBL28470333 | 0.83 | LMNA (0.74) | LMNABCHEACHEPOLBMEN1 | |
| SCHEMBL9401163 | 0.83 | LMNA (0.70) | LMNABCHEACHEPOLBMEN1 | |
| SCHEMBL30022075 | 0.82 | TRPV1 (0.45) | LMNABCHEACHEABCG2ABCB1 | |
| SCHEMBL24690631 | 0.82 | TRPV1 (0.45) | LMNABCHEACHEABCG2ABCB1 | |
| SCHEMBL7895990 | 0.80 | ALDH1A1 (0.52) | LMNAPOLBMAPTABCG2ABCB1 | |
| SCHEMBL18688577 | 0.80 | ADRA2C (0.53) | LMNABCHEACHEMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-111675725-B | Tetrahydro-beta-carbaline dimer and preparation method and application thereof | 中国药科大学 | 2023-01-24 | — | — | CN | disclosed |
| CN-111675725-A | Tetrahydro-beta-carbaline dimer and preparation method and application thereof | 中国药科大学 | 2020-09-18 | — | — | CN | disclosed |