Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 | P03956 | 3/20 | 0.53 |
| ▸ | MMP2 | P08253 | 3/20 | 0.53 |
| ▸ | MMP9 | P14780 | 2/20 | 0.53 |
| ▸ | MMP12 | P39900 | 2/20 | 0.53 |
| ▸ | NQO1 | P15559 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.39 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27803787 | 0.89 | MMP1 (0.44) | MMP1MMP2MMP9MMP12NQO1 | |
| SCHEMBL28335441 | 0.86 | ALDH1A1 (0.44) | MMP1MMP2MMP9MMP12NQO1 | |
| SCHEMBL28686546 | 0.85 | SMN1; SMN2 (0.46) | MMP1MMP2MMP9MMP12ALDH1A1 | |
| SCHEMBL28724573 | 0.85 | CD38 (0.41) | MMP1MMP2MMP9MMP12NQO1 | |
| SCHEMBL28740434 | 0.82 | MMP1 (0.40) | MMP1MMP2MMP9MMP12NQO1 | |
| SCHEMBL28740447 | 0.81 | NQO1 (0.42) | MMP1MMP2MMP9MMP12NQO1 | |
| SCHEMBL25238748 | 0.80 | MMP1 (0.49) | MMP1MMP2MMP9MMP12NQO1 | |
| SCHEMBL7630628 | 0.80 | MMP1 (0.53) | MMP1MMP2MMP9MMP12ALDH1A1 | |
| SCHEMBL22917350 | 0.80 | MMP1 (0.53) | MMP1MMP2MMP9MMP12ALDH1A1 | |
| SCHEMBL5766366 | 0.78 | ALDH1A1 (0.64) | MMP1MMP2MMP9MMP12ALDH1A1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115260211-B | Thiophene condensed ring derivative, pharmaceutical composition, preparation method and application thereof | 长春金赛药业有限责任公司 | 2024-02-06 | — | — | CN | disclosed |
| CN-115260211-A | Thiophene fused ring containing derivative, pharmaceutical composition, preparation method and application thereof | 长春金赛药业有限责任公司 | 2022-11-01 | — | — | CN | disclosed |
| CN-111925379-B | Nitrogen-containing heteroaryl substituted pyrimidinediones and uses thereof | 广东东阳光药业有限公司 | 2022-02-15 | — | — | CN | disclosed |
| CN-111793078-B | Bicyclic nitrogen-containing heteroaryl substituted pyrimidinediones and application thereof | 东莞市东阳光新药研发有限公司 | 2022-02-01 | — | — | CN | disclosed |
| CN-111925379-A | Nitrogen-containing heteroaryl substituted pyrimidinediones and uses thereof | 广东东阳光药业有限公司 | 2020-11-13 | — | — | CN | disclosed |
| CN-111793078-A | Bicyclic nitrogen-containing heteroaryl substituted pyrimidinediones and application thereof | 东莞市东阳光新药研发有限公司 | 2020-10-20 | — | — | CN | disclosed |
| WO-2011060321-A1 | TRANSGLUTAMINASE TG2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF | CHDI, INC. (US) | 2011-05-19 | — | — | WO | disclosed |