Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | PTGER1 | P34995 | 4/20 | 0.40 |
| ▸ | PTGER4 | P35408 | 4/20 | 0.40 |
| ▸ | PTGER3 | P43115 | 4/20 | 0.40 |
| ▸ | PTGER2 | P43116 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | CFD | P00746 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | IKBKB | O14920 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5544710 | 0.82 | DPP4 (0.48) | PTGER1PTGER4PTGER3PTGER2DPP4 | |
| SCHEMBL28257363 | 0.77 | DPP4 (0.42) | PTGER1PTGER4PTGER3PTGER2DPP4 | |
| SCHEMBL3787571 | 0.75 | DPP4 (0.64) | MAOAMAP4K4PTGER1PTGER4PTGER3 | |
| SCHEMBL3787028 | 0.74 | MAOA (0.50) | MAOAMAP4K4PTGER1PTGER4PTGER3 | |
| SCHEMBL2023695 | 0.72 | MAOA (0.68) | MAOAMAP4K4MAPTBRD4KDM4E | |
| SCHEMBL11406620 | 0.72 | SRC (0.40) | KDM4EALDH1A1 | |
| SCHEMBL29471388 | 0.72 | MAOA (0.68) | MAOAMAP4K4MAPTBRD4KDM4E | |
| SCHEMBL5545779 | 0.72 | MAOB (0.47) | MAOAALDH1A1 | |
| SCHEMBL177344 | 0.71 | FDPS (0.38) | ALDH1A1L3MBTL1 | |
| SCHEMBL4639752 | 0.71 | MAOB (0.61) | MAOAPTGER1PTGER4PTGER3PTGER2 |
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-110437153-A | hepatitis B core protein allosteric modulators | UNIV INDIANA RES & TECH CORP | 2019-11-12 | — | — | CN | disclosed |
| CN-106413402-A | Hepatitis b core protein allosteric modulators | 美国印第安纳大学研究和技术公司 | 2017-02-15 | — | — | CN | disclosed |