Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | APP | P05067 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27732198 | 1.00 | ALDH1A1 (0.48) | ALDH1A1MAPTTDP1L3MBTL1KDM4E | |
| Pyridazine SCHEMBL28435293 | 0.86 | ALDH1A1 (0.50) | ALDH1A1MAPTTDP1L3MBTL1KDM4E | |
| SCHEMBL28738027 | 0.80 | HTT (0.34) | ALDH1A1MAPTTDP1L3MBTL1KDM4E | |
| Hydrochloric Acid SCHEMBL29226730 | 0.80 | ALDH1A1 (0.60) | ALDH1A1MAPTTDP1L3MBTL1KDM4E | |
| Benzene SCHEMBL28083527 | 0.80 | ALDH1A1 (0.67) | ALDH1A1MAPTTDP1L3MBTL1KDM4E | |
| SCHEMBL453160 | 0.80 | ALDH1A1 (0.67) | ALDH1A1MAPTTDP1L3MBTL1KDM4E | |
| SCHEMBL30959 | 0.80 | ALDH1A1 (0.67) | ALDH1A1MAPTTDP1L3MBTL1KDM4E | |
| SCHEMBL9490577 | 0.80 | ALDH1A1 (0.67) | ALDH1A1MAPTTDP1L3MBTL1KDM4E | |
| Pyrazine SCHEMBL28194265 | 0.78 | ALDH1A1 (0.52) | ALDH1A1MAPTTDP1L3MBTL1KDM4E | |
| Methane SCHEMBL23501806 | 0.76 | ALDH1A1 (0.63) | ALDH1A1MAPTTDP1L3MBTL1KDM4E |
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-110452184-B | Conjugated microporous polymer material, and preparation monomer and application thereof | 浙江工业大学 | 2020-12-25 | — | — | CN | disclosed |