Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.63 |
| ▸ | HTR6 | P50406 | 2/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | CASP7 | P55210 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14560407 | 0.84 | HTR6 (0.63) | MAPTCYP3A4HTR6HTR2AHTR2C | |
| SCHEMBL6404659 | 0.82 | HTR6 (0.56) | MAPTCYP3A4HTR6HTR2AHTR2C | |
| SCHEMBL29956788 | 0.81 | HTT (0.51) | MAPTCYP3A4ALDH1A1KDM4ECYP2C19 | |
| SCHEMBL7380422 | 0.81 | HTT (0.51) | MAPTCYP3A4ALDH1A1KDM4ECYP2C19 | |
| SCHEMBL28804680 | 0.79 | RAB9A (0.54) | MAPTHTR6ALDH1A1KDM4EHPGD | |
| SCHEMBL29637659 | 0.78 | MAPT (0.43) | MAPTCYP3A4ALDH1A1KDM4ECYP2C19 | |
| 2-Methyl Gramine SCHEMBL2519973 | 0.78 | MAPT (1.00) | MAPTCYP3A4HTR6HTR2AHTR2C | |
| SCHEMBL14560406 | 0.77 | EGFR (0.66) | MAPTCYP3A4HTR6ALDH1A1KDM4E | |
| SCHEMBL7373958 | 0.77 | ALDH1A1 (0.54) | MAPTCYP3A4ALDH1A1KDM4ECYP2D6 | |
| SCHEMBL7380854 | 0.75 | MAPT (0.41) | MAPTCYP3A4ALDH1A1KDM4ECYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |