Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA3 | P22001 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 3/20 | 0.43 |
| ▸ | HTR2C | P28335 | 3/20 | 0.43 |
| ▸ | HTR2B | P41595 | 3/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.43 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.43 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.43 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.43 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.43 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30593300 | 0.88 | DRD2 (0.49) | KCNA3ALDH1A1KDM4EBRD4POLB | |
| SCHEMBL31070643 | 0.87 | PARP1 (0.42) | ALDH1A1KDM4EBRD4POLBCREBBP | |
| SCHEMBL31070449 | 0.86 | ADRA1D (0.46) | HTR2A | |
| SCHEMBL31070672 | 0.86 | HTR2A (0.46) | ALDH1A1HTR2AHTR2CHTR2BHSD11B1 | |
| SCHEMBL31070555 | 0.86 | KIF11 (0.47) | GABRA1GABRG2GABRB3GABRA3GABRA2 | |
| SCHEMBL31070623 | 0.85 | ECE1 (0.40) | KCNA3ALDH1A1KDM4EBRD4POLB | |
| SCHEMBL31070497 | 0.85 | NR4A2 (0.42) | MAPT | |
| SCHEMBL31070641 | 0.84 | IDO1 (0.39) | KCNA3KDM4EMAPTLMNAHSD11B1 | |
| SCHEMBL31070504 | 0.83 | CCR2 (0.39) | KCNA3ALDH1A1KDM4EBRD4POLB | |
| SCHEMBL31070501 | 0.83 | MPO (0.43) | — |
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-118515600-A | Isoindoline compound and medical application thereof | 中国科学院上海药物研究所 | 2024-08-20 | — | — | CN | disclosed |