Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.64 |
| ▸ | TSHR | P16473 | 2/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.64 |
| ▸ | CFTR | P13569 | 1/20 | 0.58 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.58 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.55 |
| ▸ | PLAU | P00749 | 2/20 | 0.50 |
| ▸ | F12 | P00748 | 1/20 | 0.50 |
| ▸ | NCF1 | P14598 | 1/20 | 0.50 |
| ▸ | NOS3 | P29474 | 1/20 | 0.50 |
| ▸ | NOS1 | P29475 | 1/20 | 0.50 |
| ▸ | NOS2 | P35228 | 1/20 | 0.50 |
| ▸ | BACE1 | P56817 | 1/20 | 0.50 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.46 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.46 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.42 |
| ▸ | PLG | P00747 | 1/20 | 0.42 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30360262 | 1.00 | CYP3A4 (0.64) | CYP3A4TSHRCYP2C19CFTRGOPC | |
| SCHEMBL762186 | 1.00 | CYP3A4 (0.64) | CYP3A4TSHRCYP2C19CFTRGOPC | |
| SCHEMBL26097343 | 0.86 | CYP3A4 (0.62) | CYP3A4TSHRCYP2C19CFTRGOPC | |
| SCHEMBL28223755 | 0.84 | CYP3A4 (0.70) | CYP3A4TSHRCYP2C19CFTRGOPC | |
| SCHEMBL26509260 | 0.84 | CYP3A4 (0.60) | CYP3A4TSHRCYP2C19CFTRGOPC | |
| SCHEMBL30018408 | 0.84 | CYP3A4 (0.60) | CYP3A4TSHRCYP2C19CFTRGOPC | |
| SCHEMBL4379626 | 0.84 | CYP3A4 (0.60) | CYP3A4TSHRCYP2C19CFTRGOPC | |
| Hydrochloric Acid SCHEMBL30017443 | 0.82 | CYP3A4 (0.58) | CYP3A4TSHRCYP2C19CFTRGOPC | |
| SCHEMBL19659677 | 0.81 | CYP3A4 (0.61) | CYP3A4TSHRCYP2C19CFTRGOPC | |
| SCHEMBL3294907 | 0.79 | CFTR (0.58) | CYP3A4TSHRCYP2C19CFTRGOPC |
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-110229192-B | Deuterated iridium complex and preparation method and application thereof | 南京佳诺霖光电科技有限公司 | 2023-04-18 | — | — | CN | claimed |