Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | VCAM1 | P19320 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.42 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.37 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.37 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | XDH | P47989 | 1/20 | 0.35 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4469699 | 0.86 | TDP1 (0.48) | TDP1VCAM1TSHRMAPK1ATM | |
| SCHEMBL9098746 | 0.81 | VCAM1 (0.46) | TDP1VCAM1TSHRMAPK1ATM | |
| SCHEMBL272834 | 0.81 | TDP1 (0.62) | TDP1VCAM1TSHRMAPK1ALDH1A1 | |
| SCHEMBL29940081 | 0.79 | TDP1 (0.63) | TDP1VCAM1TSHRMAPK1ATM | |
| SCHEMBL2551163 | 0.79 | TDP1 (0.63) | TDP1VCAM1TSHRMAPK1ATM | |
| SCHEMBL14159967 | 0.79 | TDP1 (0.44) | TDP1VCAM1TSHRMAPK1ALDH1A1 | |
| SCHEMBL31120617 | 0.79 | VCAM1 (0.43) | TDP1VCAM1TSHRMAPK1ATM | |
| SCHEMBL28753530 | 0.79 | TDP1 (0.44) | TDP1VCAM1TSHRMAPK1ATM | |
| SCHEMBL285845 | 0.78 | VCAM1 (0.46) | TDP1VCAM1TSHRMAPK1ATM | |
| Formic Acid SCHEMBL27537874 | 0.77 | TDP1 (0.43) | TDP1VCAM1TSHRMAPK1ATM |
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-117062819-A | Polycyclic compound and use thereof | 北京生命科学研究所 | 2023-11-14 | — | — | CN | disclosed |
| WO-2022199627-A1 | POLYCYCLIC COMPOUNDS AND USES THEREOF | NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) | 2022-09-29 | — | — | WO | disclosed |