Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.38 |
| ▸ | HPGD | P15428 | 8/20 | 0.38 |
| ▸ | MAPT | P10636 | 7/20 | 0.38 |
| ▸ | PKM | P14618 | 7/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.38 |
| ▸ | GAA | P10253 | 6/20 | 0.38 |
| ▸ | MEN1 | O00255 | 6/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 5/20 | 0.38 |
| ▸ | GLA | P06280 | 4/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.38 |
| ▸ | CASP1 | P29466 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | CASP7 | P55210 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7465325 | 0.78 | KDM4E (0.52) | ALDH1A1HPGDMAPTKDM4EGAA | |
| SCHEMBL7805986 | 0.77 | CASP1 (0.39) | ALDH1A1HPGDMAPTPKMKDM4E | |
| SCHEMBL19554159 | 0.76 | KDM4E (0.41) | ALDH1A1MAPTKDM4EMEN1KMT2A | |
| SCHEMBL7464636 | 0.76 | KDM4E (0.38) | ALDH1A1HPGDMAPTPKMKDM4E | |
| SCHEMBL3366391 | 0.75 | ASIC3 (0.46) | ALDH1A1HPGDMAPTPKMKDM4E | |
| SCHEMBL21176819 | 0.75 | GRM4 (0.51) | ALDH1A1MAPTKDM4EADORA2AADORA1 | |
| SCHEMBL7476653 | 0.73 | ABL1 (0.48) | ALDH1A1MAPTGAAKMT2AHTT | |
| SCHEMBL7465490 | 0.72 | ALDH1A1 (0.47) | ALDH1A1HPGDKDM4EHTTTSHR | |
| SCHEMBL6159471 | 0.72 | CDK2 (0.59) | GAAMEN1KMT2AHTTLMNA | |
| SCHEMBL7468150 | 0.71 | NPC1 (0.48) | ALDH1A1HPGDMAPTPKMKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0233461-B2 | 4,5,6-Substituted-2-pyrimidinamines | AMERICAN CYANAMID CO (US) | 2002-05-29 | — | — | EP | disclosed |