Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 13/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.35 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16041350 | 0.78 | CA2 (0.37) | CA2P2RX7 | |
| SCHEMBL19083121 | 0.77 | RPS6KA1 (0.41) | CA2 | |
| SCHEMBL2943065 | 0.77 | TSHR (0.42) | CA2P2RX7CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL23275529 | 0.76 | AKR1B1 (0.43) | P2RX7AKR1B1TSHRERCC1ERCC4 | |
| SCHEMBL3558621 | 0.75 | P2RX7 (0.51) | P2RX7CYP1A2CYP2D6CYP2C9TSHR | |
| SCHEMBL19098546 | 0.74 | MEN1 (0.30) | — | |
| SCHEMBL22659868 | 0.73 | P2RX7 (0.41) | P2RX7 | |
| SCHEMBL20047130 | 0.73 | RIPK1 (0.34) | P2RX7 | |
| SCHEMBL11884721 | 0.73 | CYP1A2 (0.42) | CYP1A2CYP2D6CYP2C9TSHRCYP2C19 | |
| SCHEMBL3883601 | 0.72 | ERCC1 (0.54) | P2RX7AKR1B1ERCC1ERCC4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106536490-A | Radioiodinated compounds | 纽泰克温图斯公司 | 2017-03-22 | — | — | CN | disclosed |