Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 8/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 8/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.58 |
| ▸ | ADRB2 | P07550 | 7/20 | 0.58 |
| ▸ | BLM | P54132 | 6/20 | 0.58 |
| ▸ | ADRB1 | P08588 | 6/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.58 |
| ▸ | RECQL | P46063 | 4/20 | 0.58 |
| ▸ | MEN1 | O00255 | 4/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.58 |
| ▸ | ADRB3 | P13945 | 4/20 | 0.58 |
| ▸ | ADRA1D | P25100 | 4/20 | 0.58 |
| ▸ | APEX1 | P27695 | 3/20 | 0.58 |
| ▸ | HPGD | P15428 | 3/20 | 0.58 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.58 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.58 |
| ▸ | DRD2 | P14416 | 3/20 | 0.58 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.58 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.58 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL3442521 | 0.80 | MAPT (0.62) | MAPTTDP1KDM4EADRB2BLM | |
| SCHEMBL30104601 | 0.80 | MAPT (0.62) | MAPTTDP1KDM4EADRB2BLM | |
| SCHEMBL6551806 | 0.80 | TSHR (0.67) | TDP1BLMMEN1KMT2AHPGD | |
| SCHEMBL13395853 | 0.79 | TDP1 (0.47) | MAPTTDP1KDM4EADRB2BLM | |
| SCHEMBL10352003 | 0.79 | TDP1 (0.43) | MAPTTDP1KDM4EADRB2BLM | |
| SCHEMBL28286504 | 0.77 | BLM (0.47) | MAPTTDP1KDM4EADRB2BLM | |
| SCHEMBL31378993 | 0.76 | HTR1A (0.42) | CYP3A4LMNAALDH1A1CYP2D6POLB | |
| SCHEMBL29457616 | 0.75 | MAPT (0.67) | MAPTTDP1KDM4EADRB2BLM | |
| SCHEMBL141609 | 0.75 | MAPT (0.67) | MAPTTDP1KDM4EADRB2BLM | |
| SCHEMBL31379007 | 0.74 | MEN1 (0.53) | MEN1KMT2ACYP3A4TSHRHIF1A |
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-108752208-B | Extraction method of caffeoylquinic acid compounds, and product and application thereof | 深圳市人民医院 | 2021-03-16 | — | — | CN | disclosed |