Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GUSB | P08236 | 4/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.38 |
| ▸ | PDE5A | O76074 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CHRNE | Q04844 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 6/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28899922 | 0.90 | GUSB (0.39) | GUSBABCB1ABCG2HDAC6HDAC2 | |
| SCHEMBL30148066 | 0.88 | HDAC6 (0.37) | GUSBPDE5AHDAC6HDAC1PTGDR2 | |
| SCHEMBL28464318 | 0.88 | HDAC6 (0.37) | GUSBPDE5AHDAC6HDAC1PTGDR2 | |
| SCHEMBL30148131 | 0.84 | PDE5A (0.38) | GUSBABCB1ABCG2PDE5ACHRNE | |
| SCHEMBL28464365 | 0.80 | AKR1B10 (0.45) | HDAC6HDAC1PTGDR2 | |
| SCHEMBL28471570 | 0.77 | LMNA (0.51) | ABCB1ABCG2POLBKDM4EGAA | |
| SCHEMBL30148104 | 0.76 | ABCB1 (0.50) | ABCB1ABCG2PDE5APOLBHDAC6 | |
| SCHEMBL28470335 | 0.72 | ABCB1 (0.43) | ABCB1ABCG2PDE5APOLBHDAC6 | |
| SCHEMBL28473847 | 0.67 | ABCB1 (0.47) | ABCB1ABCG2HDAC6HDAC2HDAC8 | |
| SCHEMBL28476647 | 0.66 | ABCB1 (0.50) | ABCB1ABCG2HDAC6HDAC2HDAC8 |
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 |