Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 5/20 | 0.67 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.49 |
| ▸ | MEN1 | O00255 | 4/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.43 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL23224250 | 0.85 | HPGD (0.69) | HPGDHDAC1KMT2AMEN1CYP1A2 | |
| SCHEMBL19454817 | 0.85 | HPGD (0.69) | HPGDHDAC1KMT2AMEN1CYP1A2 | |
| SCHEMBL25443717 | 0.84 | HPGD (0.48) | HPGDHDAC1KMT2AMEN1CYP1A2 | |
| SCHEMBL25063740 | 0.82 | HDAC3 (0.51) | HPGDHDAC1KMT2AMEN1CYP1A2 | |
| SCHEMBL25443753 | 0.82 | HPGD (0.52) | HPGDHDAC1KMT2AMEN1CYP1A2 | |
| SCHEMBL12019303 | 0.81 | HPGD (0.73) | HPGDKMT2AMEN1CYP1A2CYP3A4 | |
| SCHEMBL24670283 | 0.81 | HPGD (0.73) | HPGDHDAC1KMT2AMEN1CYP1A2 | |
| SCHEMBL25443716 | 0.81 | MEN1 (0.56) | HPGDHDAC1KMT2AMEN1CYP1A2 | |
| SCHEMBL12553186 | 0.81 | HPGD (0.67) | HPGDHDAC1KMT2AMEN1CYP1A2 | |
| SCHEMBL13965859 | 0.80 | HPGD (0.71) | HPGDKMT2AMEN1CYP1A2CYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230146870-A1 | METHOD TO QUANTIFY AFFINITY AND SELECTIVITY OF SMALL MOLECULES FOR PROTEINS IN LIVING CELLS | OHIO STATE INNOVATION FOUNDATION | 2023-05-11 | — | — | US | disclosed |
| US-20230146870-A1 | METHOD TO QUANTIFY AFFINITY AND SELECTIVITY OF SMALL MOLECULES FOR PROTEINS IN LIVING CELLS | OHIO STATE INNOVATION FOUNDATION | 2023-05-11 | — | — | US | disclosed |