Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | BCHE | P06276 | 1/20 | 0.50 |
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3182861 | 0.80 | CA1 (0.55) | CA1CA2BCHEACHEALDH1A1 | |
| SCHEMBL4521634 | 0.79 | ALDH1A1 (0.50) | ALDH1A1MAPK1LMNAMAPTKDM4E | |
| SCHEMBL28904631 | 0.77 | CA1 (0.38) | CA1CA2BCHEACHETSHR | |
| SCHEMBL29363788 | 0.76 | CA1 (0.62) | CA1CA2BCHEACHEALDH1A1 | |
| SCHEMBL317481 | 0.74 | ALDH1A1 (0.56) | ALDH1A1TSHRCYP3A4MAPK1HSD17B10 | |
| SCHEMBL17046393 | 0.74 | MAPT (0.49) | ALDH1A1MAPK1LMNAMAPTMEN1 | |
| SCHEMBL29130398 | 0.73 | CA1 (0.35) | CA1CA2BCHEACHEALDH1A1 | |
| SCHEMBL30705761 | 0.73 | TTR (0.48) | CA1CA2BCHEACHEALDH1A1 | |
| SCHEMBL30186612 | 0.73 | ALDH3A1 (0.49) | CA1CA2BCHEACHEALDH1A1 | |
| SCHEMBL21268339 | 0.72 | NPC1 (0.50) | ALDH1A1MAPK1LMNAMAPTKDM4E |
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-111954525-B | Prodrugs of fused bicyclic C5aR antagonists | 凯莫森特里克斯股份有限公司 | 2023-12-26 | — | — | CN | disclosed |