Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP3A5 | P20815 | 2/20 | 0.43 |
| ▸ | CYP3A7 | P24462 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.43 |
| ▸ | CYP3A43 | Q9HB55 | 2/20 | 0.43 |
| ▸ | DDB1 | Q16531 | 10/20 | 0.42 |
| ▸ | CRBN | Q96SW2 | 10/20 | 0.42 |
| ▸ | MAP4K3 | Q8IVH8 | 1/20 | 0.36 |
| ▸ | IKZF3 | Q9UKT9 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.35 |
| ▸ | ACVRL1 | P37023 | 2/20 | 0.35 |
| ▸ | ACVR1 | Q04771 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29079611 | 1.00 | CYP1A2 (0.43) | CYP1A2CYP3A4CYP3A5CYP3A7CYP2C19 | |
| SCHEMBL29079612 | 1.00 | CYP1A2 (0.43) | CYP1A2CYP3A4CYP3A5CYP3A7CYP2C19 | |
| SCHEMBL29768076 | 1.00 | CYP1A2 (0.43) | CYP1A2CYP3A4CYP3A5CYP3A7CYP2C19 | |
| SCHEMBL29768007 | 1.00 | CYP1A2 (0.43) | CYP1A2CYP3A4CYP3A5CYP3A7CYP2C19 | |
| SCHEMBL29768214 | 0.89 | CRBN (0.41) | CYP1A2CYP3A4CYP3A5CYP3A7CYP2C19 | |
| SCHEMBL29079641 | 0.89 | CRBN (0.41) | CYP1A2CYP3A4CYP3A5CYP3A7CYP2C19 | |
| SCHEMBL29768052 | 0.88 | CRBN (0.42) | CYP1A2CYP3A4CYP3A5CYP3A7CYP2C19 | |
| SCHEMBL29079660 | 0.86 | CRBN (0.41) | CYP1A2CYP3A4CYP3A5CYP3A7CYP2C19 | |
| SCHEMBL30574657 | 0.86 | CRBN (0.41) | CYP1A2CYP3A4CYP3A5CYP3A7CYP2C19 | |
| SCHEMBL29079656 | 0.86 | CRBN (0.41) | CYP1A2CYP3A4CYP3A5CYP3A7CYP2C19 |
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-116648248-A | Aromatic compound, pharmaceutical composition containing same and application thereof | 成都茵创园医药科技有限公司 | 2023-08-25 | — | — | CN | disclosed |