Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 14/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.62 |
| ▸ | GAA | P10253 | 8/20 | 0.62 |
| ▸ | HPGD | P15428 | 7/20 | 0.62 |
| ▸ | GLA | P06280 | 3/20 | 0.62 |
| ▸ | TSHR | P16473 | 4/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.52 |
| ▸ | CASP1 | P29466 | 4/20 | 0.52 |
| ▸ | CASP7 | P55210 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | NOTCH1 | P46531 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL3328903 | 0.89 | KDM4E (0.64) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL5231926 | 0.86 | KDM4E (0.52) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL7981102 | 0.85 | HSD17B10 (0.64) | KDM4EALDH1A1GAAHPGDTSHR | |
| SCHEMBL3354067 | 0.85 | KDM4E (0.64) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL3323326 | 0.83 | KDM4E (0.69) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL3324047 | 0.83 | KDM4E (0.57) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL5226813 | 0.82 | GSK3B (0.56) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL3326229 | 0.82 | KDM4E (0.78) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL3329935 | 0.81 | ALOX15 (0.53) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL8080963 | 0.81 | KMT2A (0.47) | KDM4EALDH1A1GAAHPGDGLA |
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-6194428-B1 | BRAIN DISORDERS; PSYCHOLOGICAL DISORDERS | BAYER AKTIENGESELLSCHAFT (DE) | 2001-02-27 | — | — | US | disclosed |