Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.39 |
| ▸ | PLG | P00747 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | CTSG | P08311 | 1/20 | 0.39 |
| ▸ | CMA1 | P23946 | 1/20 | 0.39 |
| ▸ | CTRC | Q99895 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14620036 | 0.84 | ALDH1A1 (0.48) | ALDH1A1MAPK1SMN1; SMN2HTTMT-CO2 | |
| SCHEMBL8383162 | 0.69 | ALDH1A1 (1.00) | ALDH1A1MAPK1SMN1; SMN2HTTMT-CO2 | |
| SCHEMBL8383160 | 0.69 | ALDH1A1 (1.00) | ALDH1A1MAPK1SMN1; SMN2HTTMT-CO2 | |
| SCHEMBL14620057 | 0.68 | DRD1 (0.35) | ALDH1A1MAPK1SMN1; SMN2MT-CO2ALOX5 | |
| SCHEMBL31319925 | 0.68 | ALDH1A1 (0.54) | ALDH1A1MAPK1SMN1; SMN2HTTMT-CO2 | |
| SCHEMBL3716740 | 0.66 | ALDH1A1 (0.93) | ALDH1A1MAPK1SMN1; SMN2MT-CO2ALOX5 | |
| SCHEMBL7829113 | 0.66 | ALDH1A1 (0.93) | ALDH1A1MAPK1SMN1; SMN2MT-CO2ALOX5 | |
| SCHEMBL6282881 | 0.65 | CASP3 (0.51) | ALDH1A1MAPK1SMN1; SMN2HTTTSHR | |
| SCHEMBL14529645 | 0.64 | ALDH1A1 (0.53) | ALDH1A1CYP19A1 | |
| SCHEMBL14620183 | 0.64 | ALDH1A1 (0.33) | ALDH1A1 |
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-2007003520-A1 | FLUORESCENT DIKETOPYRROLOPYRROLES AND DERIVATIVES | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2007-01-11 | — | — | WO | disclosed |