Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.37 |
| ▸ | IDH1 | O75874 | 1/20 | 0.37 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.37 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.36 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | NNMT | P40261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL160602 | 0.82 | BTK (0.47) | BTKPOLBTDP1ALOX5DDB1 | |
| SCHEMBL1762113 | 0.79 | CCR1 (0.43) | ALOX5GRM4KDM4EALDH1A1HPGD | |
| SCHEMBL29432664 | 0.75 | IDH1 (0.47) | BTKNFE2L2ALOX5IDH1DDB1 | |
| SCHEMBL506568 | 0.75 | IDH1 (0.47) | BTKNFE2L2ALOX5IDH1DDB1 | |
| SCHEMBL15248967 | 0.75 | KDM4E (0.57) | TDP1KDM4E | |
| SCHEMBL13727492 | 0.73 | SOAT1 (0.40) | TDP1 | |
| SCHEMBL13063993 | 0.72 | BTK (0.39) | BTKPOLBTDP1NFE2L2ALOX5 | |
| Formic Acid SCHEMBL28565943 | 0.72 | CCR1 (0.40) | BTKPOLBTDP1NFE2L2ALOX5 | |
| SCHEMBL128704 | 0.71 | — | — | |
| SCHEMBL648648 | 0.71 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105030750-B | Application of one group of cajanin structurally similar compounds in anti-hepatitis C virus and anti AIDS virus | 中国医学科学院医药生物技术研究所 | 2018-08-28 | — | — | CN | disclosed |
| CN-103172512-B | A group of compounds with similar cajanin structure, preparation method and application | 中国医学科学院医药生物技术研究所 | 2016-08-03 | — | — | CN | disclosed |
| CN-105030750-A | Application of longistyline structural analogues in prevention of hepatitis C virus and acquired immune deficiency syndrome (AIDS) virus | INST MED BIOTECHNOLOGY CAMS | 2015-11-11 | — | — | CN | disclosed |