Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC9A1 | P19634 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | KMO | O15229 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CCR1 | P32246 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL25443738 | 0.88 | ADAMTS5 (0.43) | KMODRD3KCNH2HRH3CCR1 | |
| SCHEMBL25443737 | 0.86 | ADAMTS5 (0.41) | KMODRD3KCNH2HRH3ALDH1A1 | |
| SCHEMBL25443736 | 0.85 | ADAMTS5 (0.43) | DRD3KCNH2HRH3ALDH1A1 | |
| SCHEMBL25443735 | 0.84 | ADAMTS5 (0.42) | DRD3ALDH1A1 | |
| SCHEMBL25443734 | 0.84 | ADAMTS5 (0.42) | DRD3ALDH1A1 | |
| SCHEMBL25443733 | 0.78 | CYP2C9 (0.53) | CYP2C9CYP2C19KDM4EKMT2AMEN1 | |
| SCHEMBL14434315 | 0.74 | POLB (0.59) | SLC9A1CYP2C9CYP2C19KDM4EPTPN1 | |
| SCHEMBL10291744 | 0.74 | CCR1 (0.49) | SLC9A1CYP2C9CYP2C19KDM4EPTPN1 | |
| SCHEMBL10291725 | 0.74 | POLB (0.62) | SLC9A1CYP2C9CYP2C19KDM4EPTPN1 | |
| SCHEMBL10291735 | 0.74 | CCR1 (0.65) | POLBKCNH2CCR1 |
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 |