Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.44 |
| ▸ | MMP8 | P22894 | 2/20 | 0.43 |
| ▸ | MMP3 | P08254 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 3/20 | 0.42 |
| ▸ | HTR7 | P34969 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | PRMT5 | O14744 | 7/20 | 0.41 |
| ▸ | WDR77 | Q9BQA1 | 7/20 | 0.41 |
| ▸ | FNTA | P49354 | 1/20 | 0.40 |
| ▸ | FNTB | P49356 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6920539 | 0.81 | HTR1A (0.50) | OPRM1MMP3HTR1AHTR7 | |
| SCHEMBL29870443 | 0.74 | ACE (0.49) | MMP8MMP3LMNAPOLBL3MBTL1 | |
| SCHEMBL8336724 | 0.74 | ACE (0.49) | MMP8MMP3LMNAPOLBL3MBTL1 | |
| SCHEMBL7478005 | 0.74 | ACE (0.49) | MMP8MMP3LMNAPOLBL3MBTL1 | |
| SCHEMBL5900780 | 0.74 | HSD11B1 (0.61) | MMP8HSD11B1POLB | |
| SCHEMBL18953046 | 0.73 | SIRT2 (0.45) | MMP8MMP3HTR1AHTR7KDM4E | |
| Hydrochloric Acid SCHEMBL5901272 | 0.73 | HSD11B1 (0.60) | MMP8HSD11B1POLB | |
| SCHEMBL8342126 | 0.73 | MMP8 (0.58) | MMP8MMP3POLBL3MBTL1 | |
| SCHEMBL8342131 | 0.73 | MMP8 (0.58) | MMP8MMP3POLBL3MBTL1 | |
| SCHEMBL7477932 | 0.73 | FNTA (0.56) | FNTAFNTB |
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-109776414-A | A kind of Bcl-2 protein inhibitor and its preparation method and application | 山东大学 | 2019-05-21 | — | — | CN | disclosed |