Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17085960 | 0.88 | POLB (0.49) | ALDH1A1LMNAKMT2APOLBKDM4E | |
| SCHEMBL29441709 | 0.88 | POLB (0.49) | ALDH1A1LMNAKMT2APOLBKDM4E | |
| SCHEMBL28118636 | 0.88 | KMT2A (0.41) | ALDH1A1KMT2AKDM4EGLAMEN1 | |
| SCHEMBL17080210 | 0.88 | HCAR3 (0.50) | ALDH1A1LMNAKMT2APOLBKDM4E | |
| SCHEMBL7119414 | 0.79 | AR (0.51) | ARALDH1A1LMNAKMT2APOLB | |
| SCHEMBL28230871 | 0.77 | ALDH1A1 (0.48) | ALDH1A1LMNAKMT2APOLBL3MBTL1 | |
| SCHEMBL17080189 | 0.77 | HCAR3 (0.58) | ALDH1A1KMT2APOLBKDM4EGLA | |
| SCHEMBL29441730 | 0.76 | VCAM1 (0.50) | ALDH1A1LMNAKMT2APOLBKDM4E | |
| SCHEMBL18381542 | 0.76 | VCAM1 (0.50) | ALDH1A1LMNAKMT2APOLBKDM4E | |
| SCHEMBL18666979 | 0.74 | HCAR3 (0.50) | ALDH1A1LMNAKMT2APOLBL3MBTL1 |
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 |