Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 7/20 | 0.66 |
| ▸ | CPT2 | P23786 | 3/20 | 0.61 |
| ▸ | CPT1A | P50416 | 3/20 | 0.61 |
| ▸ | CPT1B | Q92523 | 2/20 | 0.61 |
| ▸ | HTR1A | P08908 | 1/20 | 0.59 |
| ▸ | HTR1D | P28221 | 1/20 | 0.59 |
| ▸ | HTR1F | P30939 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | MEN1 | O00255 | 3/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | HTT | P42858 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.53 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.53 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.53 |
| ▸ | RORA | P35398 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL15625873 | 0.86 | RORC (0.68) | RORCCPT2CPT1ACPT1BNR1H2 | |
| SCHEMBL5021975 | 0.84 | RORC (0.75) | RORCCPT2CPT1ACPT1BNR1H2 | |
| SCHEMBL28157203 | 0.82 | ALDH1A1 (0.64) | RORCALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL5021967 | 0.82 | CPT1A (0.60) | RORCCPT2CPT1ACPT1BMAPT | |
| SCHEMBL5021974 | 0.81 | CPT1A (0.56) | RORCCPT2CPT1ACPT1BALDH1A1 | |
| SCHEMBL28843028 | 0.80 | RORC (0.58) | RORCCPT2CPT1ACPT1BALDH1A1 | |
| SCHEMBL5021972 | 0.80 | CPT1A (0.58) | RORCCPT2CPT1ACPT1BMAPT | |
| SCHEMBL2001650 | 0.80 | CNR1 (0.67) | RORCCPT2CPT1ACPT1BALDH1A1 | |
| SCHEMBL755026 | 0.79 | CPT1A (0.80) | RORCCPT2CPT1ACPT1BALDH1A1 | |
| SCHEMBL1999963 | 0.79 | CYP2C9 (0.56) | RORCCPT2CPT1ACPT1BALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107021923-B | Tetrahydroquinoline related bicyclic compound and application thereof | 中国科学院广州生物医药与健康研究院 | 2022-09-23 | — | — | CN | claimed |
| CN-107021923-B | Tetrahydroquinoline related bicyclic compound and application thereof | 中国科学院广州生物医药与健康研究院 | 2022-09-23 | — | — | CN | disclosed |
| CN-114790169-A | Tetrahydroquinoline related bicyclic compound and application thereof | 中国科学院广州生物医药与健康研究院 | 2022-07-26 | — | — | CN | disclosed |