Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | RORC | P51449 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.51 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29817770 | 1.00 | TSHR (0.65) | TSHRALDH1A1NPSR1RORCHTT | |
| SCHEMBL29817651 | 0.81 | TSHR (0.70) | TSHRALDH1A1NPSR1RORCHTT | |
| SCHEMBL28823923 | 0.81 | TSHR (0.70) | TSHRALDH1A1NPSR1RORCHTT | |
| SCHEMBL29767731 | 0.78 | NLRP3 (0.57) | ALDH1A1HTTKMT2AMEN1MAPT | |
| SCHEMBL4560338 | 0.78 | RORC (0.58) | RORCCYP11B1CYP11B2KMT2AMEN1 | |
| SCHEMBL29817604 | 0.78 | RORC (0.58) | RORCCYP11B1CYP11B2KMT2AMEN1 | |
| SCHEMBL4561216 | 0.78 | KMT2A (0.56) | ALDH1A1HTTRAB9ACYP11B1CYP11B2 | |
| SCHEMBL18359172 | 0.75 | KMT2A (0.45) | RORCHTTRAB9AKMT2AMEN1 | |
| SCHEMBL22341682 | 0.75 | MAPT (0.47) | TSHRALDH1A1NPSR1HTTRAB9A | |
| SCHEMBL17507378 | 0.75 | NLRP3 (0.47) | ALDH1A1NPSR1HTTRAB9AHPGD |
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 2 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 | 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 |