Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | ENPP2 | Q13822 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL25443732 | 0.88 | MEN1 (0.50) | KDM4EMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL25443731 | 0.85 | MAPT (0.51) | KDM4EMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL25443730 | 0.84 | MAPT (0.53) | KDM4EMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL25443711 | 0.84 | POLB (0.55) | CYP2C9CYP2C19KDM4EMEN1KMT2A | |
| SCHEMBL25443727 | 0.83 | MAPT (0.52) | KDM4EMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL25443729 | 0.83 | MAPT (0.52) | KDM4EMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL25444164 | 0.83 | MAPT (0.54) | KDM4EMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL25443748 | 0.82 | P2RX7 (0.42) | CYP2C9CYP2C19KDM4EMEN1KMT2A | |
| SCHEMBL25444272 | 0.81 | LMNA (0.43) | CYP2C9CYP2C19KDM4EMEN1KMT2A | |
| SCHEMBL22209344 | 0.81 | HTR2C (0.62) | KDM4EMEN1KMT2AALDH1A1RAB9A |
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 |