Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | PLA2G2C | Q5R387 | 1/20 | 0.35 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Malonic Acid SCHEMBL16458514 | 0.85 | MAPT (0.53) | MAPTABCC4ALDH1A1TSHRLMNA | |
| SCHEMBL5859613 | 0.84 | MAPT (0.48) | MAPTABCC4ALDH1A1TSHRLMNA | |
| Malonic Acid SCHEMBL6827749 | 0.81 | TDP1 (0.44) | MAPTABCC4ALDH1A1TSHRLMNA | |
| SCHEMBL5856750 | 0.78 | MAPT (0.52) | MAPTABCC4ALDH1A1TSHRLMNA | |
| Malonic Acid SCHEMBL28444216 | 0.77 | TSHR (0.67) | MAPTABCC4ALDH1A1TSHRLMNA | |
| SCHEMBL9495920 | 0.77 | MAPT (0.56) | MAPTABCC4ALDH1A1TSHRLMNA | |
| SCHEMBL7088338 | 0.77 | MAPT (0.56) | MAPTABCC4ALDH1A1TSHRLMNA | |
| SCHEMBL5369364 | 0.77 | MAPT (0.56) | MAPTABCC4ALDH1A1TSHRLMNA | |
| SCHEMBL11512450 | 0.77 | MAPT (0.56) | MAPTABCC4ALDH1A1TSHRLMNA | |
| Malonic Acid SCHEMBL31310465 | 0.76 | TSHR (0.60) | MAPTABCC4ALDH1A1TSHRLMNA |
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-2004076425-A1 | IMPROVED SYNTHESIS OF MACROCYCLIC TETRAAMIDO COMPOUNDS AND NEW METAL INSERTION PROCESS | CARNEGIE MELLON UNIVERSITY (US) | 2004-09-10 | — | — | WO | disclosed |