Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | PLAU | P00749 | 1/20 | 0.44 |
| ▸ | PTPRC | P08575 | 1/20 | 0.44 |
| ▸ | S100A4 | P26447 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | MMP1 | P03956 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | MMP8 | P22894 | 1/20 | 0.43 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
| ▸ | CTSD | P07339 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8521008 | 1.00 | CYP1A2 (0.58) | CYP1A2ALDH1A1TSHRGPR35HSD17B10 | |
| SCHEMBL3697952 | 0.89 | CYP1A2 (0.59) | CYP1A2ALDH1A1TSHRGPR35HSD17B10 | |
| SCHEMBL506668 | 0.87 | CYP1A2 (0.58) | CYP1A2ALDH1A1TSHRGPR35HSD17B10 | |
| SCHEMBL888202 | 0.83 | ALDH1A1 (0.57) | CYP1A2ALDH1A1TSHRGPR35HSD17B10 | |
| SCHEMBL5281897 | 0.83 | CYP1A2 (0.64) | CYP1A2ALDH1A1TSHRGPR35HSD17B10 | |
| SCHEMBL10230494 | 0.83 | CYP1A2 (0.54) | CYP1A2ALDH1A1TSHRGPR35HSD17B10 | |
| SCHEMBL6256628 | 0.83 | ALDH1A1 (0.57) | CYP1A2ALDH1A1TSHRGPR35HSD17B10 | |
| SCHEMBL12232403 | 0.83 | CYP1A2 (0.54) | CYP1A2ALDH1A1TSHRGPR35HSD17B10 | |
| SCHEMBL14436535 | 0.83 | CYP1A2 (0.54) | CYP1A2ALDH1A1TSHRGPR35HSD17B10 | |
| SCHEMBL31146698 | 0.83 | ALDH1A1 (0.57) | CYP1A2ALDH1A1TSHRGPR35HSD17B10 |
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-118440025-B | Zhu Gongjun acid derivative and preparation method and application thereof | 济南爱思医药科技有限公司 | 2024-09-17 | — | — | CN | disclosed |
| CN-118440025-A | Zhu Gongjun acid derivative and preparation method and application thereof | 济南爱思医药科技有限公司 | 2024-08-06 | — | — | CN | disclosed |