Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.77 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.77 |
| ▸ | GAA | P10253 | 2/20 | 0.77 |
| ▸ | HPGD | P15428 | 2/20 | 0.77 |
| ▸ | CASP1 | P29466 | 2/20 | 0.77 |
| ▸ | CASP7 | P55210 | 2/20 | 0.77 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.77 |
| ▸ | MEN1 | O00255 | 1/20 | 0.77 |
| ▸ | SRC | P12931 | 1/20 | 0.77 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.77 |
| ▸ | ATM | Q13315 | 1/20 | 0.77 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.77 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.77 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.58 |
| ▸ | AR | P10275 | 12/20 | 0.51 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.49 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.49 |
| ▸ | AGER | Q15109 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL144309 | 0.87 | KDM4E (1.00) | KDM4EALDH1A1GAAHPGDCASP1 | |
| SCHEMBL29356441 | 0.87 | KDM4E (1.00) | KDM4EALDH1A1GAAHPGDCASP1 | |
| SCHEMBL15843573 | 0.81 | HSD17B3 (0.59) | KDM4EALDH1A1GAAHPGDCASP1 | |
| Glycine SCHEMBL9259892 | 0.77 | KDM4E (0.79) | KDM4EALDH1A1GAAHPGDCASP1 | |
| SCHEMBL8629120 | 0.77 | NQO1 (0.55) | KDM4EALDH1A1GAAHPGDCASP1 | |
| SCHEMBL30124129 | 0.77 | NQO1 (0.55) | KDM4EALDH1A1GAAHPGDCASP1 | |
| SCHEMBL4620259 | 0.76 | KDM4E (0.68) | KDM4EALDH1A1GAAHPGDCASP1 | |
| Alanine SCHEMBL15556780 | 0.75 | KDM4E (0.75) | KDM4EALDH1A1GAAHPGDCASP1 | |
| SCHEMBL15842662 | 0.75 | HSD17B3 (0.69) | KDM4EALDH1A1GAAHPGDCASP1 | |
| SCHEMBL2169023 | 0.74 | ALDH1A1 (0.74) | KDM4EALDH1A1GAAHPGDCASP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6277583-B1 | COMBINING A MIXTURE OF PROTEINS COMPRISING THE TARGET PROTEIN WITH AN AFFINITY LABEL CONJUGATE COMPRISING AN OLIGOMER AND A BIOLOGICALLY ACTIVE COMPOUND AND HAS AN ACTIVATED FUNCTIONAL GROUP WHICH COVALENTLY BONDS TO THE TARGET PROTEIN | CONJUCHEM, INC. (CA) | 2001-08-21 | — | — | US | disclosed |
| EP-0885390-A1 | AFFINITY LABELING LIBRARIES AND APPLICATIONS THEREOF | Redcell Canada Inc. (CA) | 1998-12-23 | — | — | EP | disclosed |
| WO-1997029372-A1 | AFFINITY LABELING LIBRARIES AND APPLICATIONS THEREOF | CONJUCHEM, INC. (CA) | 1997-08-14 | — | — | WO | disclosed |