Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 2/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.39 |
| ▸ | CNR2 | P34972 | 7/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CASR | P41180 | 1/20 | 0.37 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8134445 | 0.80 | CYP19A1 (0.46) | P2RX7CYP19A1CYP17A1CNR2MEN1 | |
| SCHEMBL30443838 | 0.80 | ALDH1A1 (0.49) | P2RX7CYP19A1CYP17A1CNR2MEN1 | |
| Water SCHEMBL28770286 | 0.78 | CNR2 (0.47) | P2RX7CNR2MEN1ALDH1A1KMT2A | |
| SCHEMBL24804782 | 0.75 | P2RX7 (0.42) | P2RX7CYP19A1CYP17A1CNR2MEN1 | |
| SCHEMBL19306386 | 0.72 | HSP90AA1 (0.45) | CYP19A1CYP17A1CNR2MEN1ALDH1A1 | |
| SCHEMBL29601872 | 0.72 | ALDH1A1 (0.58) | CYP19A1CYP2D6CYP2C9CYP2C19MEN1 | |
| SCHEMBL228051 | 0.72 | ALDH1A1 (0.58) | CYP19A1CYP2D6CYP2C9CYP2C19MEN1 | |
| SCHEMBL27613393 | 0.72 | CYP2D6 (0.48) | CYP19A1CYP2D6CYP2C9CYP2C19MEN1 | |
| SCHEMBL27255740 | 0.71 | RAB9A (0.54) | CYP2C9CYP2C19CNR2MEN1ALDH1A1 | |
| SCHEMBL8129733 | 0.71 | HSP90AA1 (0.48) | P2RX7CYP19A1CYP2C9CYP2C19CYP17A1 |
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-108883099-B | Thiazolidinone compounds and use thereof | 石全 | 2021-09-28 | — | — | CN | disclosed |