Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 5/20 | 0.41 |
| ▸ | MAOA | P21397 | 2/20 | 0.41 |
| ▸ | GPR35 | Q9HC97 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25444937 | 1.00 | MAOB (0.41) | MAOBMAOAGPR35ALDH1A1KDM4E | |
| SCHEMBL25166839 | 0.88 | MAOB (0.43) | MAOBMAOAGPR35ALDH1A1KDM4E | |
| SCHEMBL25166841 | 0.88 | MAOB (0.43) | MAOBMAOAGPR35ALDH1A1KDM4E | |
| SCHEMBL30423318 | 0.84 | AKR1B10 (0.43) | MAOBMAOAALDH1A1KDM4EHSD17B10 | |
| SCHEMBL30422928 | 0.84 | AKR1B10 (0.43) | MAOBMAOAALDH1A1KDM4EHSD17B10 | |
| SCHEMBL25167999 | 0.84 | AKR1B10 (0.43) | MAOBMAOAALDH1A1KDM4EHSD17B10 | |
| SCHEMBL25168020 | 0.84 | AKR1B10 (0.43) | MAOBMAOAALDH1A1KDM4EHSD17B10 | |
| SCHEMBL25443860 | 0.79 | GPR35 (0.40) | MAOBMAOAGPR35ALDH1A1KDM4E | |
| SCHEMBL25444939 | 0.78 | MAOB (0.56) | MAOBMAOAALDH1A1KDM4EMEN1 | |
| SCHEMBL25167167 | 0.75 | NAAA (0.44) | MAOBMAOAALDH1A1KDM4EHSD17B10 |
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-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 |