Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.57 |
| ▸ | MAPT | P10636 | 5/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | ESR1 | P03372 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HTR6 | P50406 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11313668 | 0.83 | ALDH1A1 (0.53) | ALDH1A1MAPTKDM4ELMNAKMT2A | |
| SCHEMBL9506440 | 0.83 | ALDH1A1 (0.53) | ALDH1A1MAPTKDM4ELMNAKMT2A | |
| Water SCHEMBL11792457 | 0.81 | ALDH1A1 (0.52) | ALDH1A1MAPTKDM4ELMNAKMT2A | |
| Water SCHEMBL11798808 | 0.81 | ALDH1A1 (0.52) | ALDH1A1MAPTKDM4ELMNAKMT2A | |
| SCHEMBL7771730 | 0.77 | ALDH1A1 (0.62) | ALDH1A1MAPTKDM4ELMNAKMT2A | |
| SCHEMBL10425537 | 0.77 | F2 (0.67) | ALDH1A1MAPTKDM4ELMNAKMT2A | |
| SCHEMBL9398028 | 0.73 | TSHR (0.52) | ALDH1A1MAPTKDM4ELMNAKMT2A | |
| SCHEMBL8956577 | 0.72 | KMT2A (1.00) | ALDH1A1MAPTKDM4ELMNAKMT2A | |
| SCHEMBL7773233 | 0.72 | KMT2A (0.61) | ALDH1A1MAPTKDM4ELMNAKMT2A | |
| SCHEMBL3618541 | 0.72 | MAPT (1.00) | ALDH1A1MAPTKDM4ELMNAKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996026939-A1 | CARBAPENEM COMPOUNDS, THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-09-06 | — | — | WO | disclosed |