Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | BRD1 | O95696 | 1/20 | 0.38 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.38 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 3/20 | 0.36 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | DRD3 | P35462 | 2/20 | 0.36 |
| ▸ | PHGDH | O43175 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1270502 | 0.82 | MAT2A (0.44) | KDM4EPTK2KMT2ABRD1BRPF1 | |
| SCHEMBL6660146 | 0.82 | HSP90AA1 (0.43) | HSP90AA1KDM4EROCK1PTK2KMT2A | |
| SCHEMBL7555058 | 0.82 | ROCK1 (0.45) | MAOBKDM4EROCK1RXFP1MAPT | |
| SCHEMBL699112 | 0.81 | BIRC5 (0.43) | HSP90AA1KDM4EROCK1PTK2KMT2A | |
| SCHEMBL30097476 | 0.81 | BIRC5 (0.43) | HSP90AA1KDM4EROCK1PTK2KMT2A | |
| SCHEMBL16383852 | 0.80 | KMT2A (0.43) | KDM4EMAPTPTK2KMT2ABRD1 | |
| SCHEMBL6845146 | 0.78 | RXRA (0.48) | KDM4EKMT2AALDH1A1 | |
| SCHEMBL28894029 | 0.77 | MAOB (0.46) | MAOBHSP90AA1ROCK1RXFP1MAPT | |
| SCHEMBL31454914 | 0.77 | ROCK1 (0.51) | MAOBHSP90AA1KDM4EROCK1RXFP1 | |
| SCHEMBL6655307 | 0.76 | CYP11B1 (0.52) | KDM4EMAPTPTK2CYP1A2 |
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-105061436-A | Preparation method of polysubstituted thick indole and indole compound | UNIV TSINGHUA | 2015-11-18 | — | — | CN | claimed |
| CN-105061436-B | A kind of preparation method of polysubstituted condensed indole diindyl class compound | 清华大学 | 2017-08-11 | — | — | CN | disclosed |
| CN-105061436-A | Preparation method of polysubstituted thick indole and indole compound | UNIV TSINGHUA | 2015-11-18 | — | — | CN | disclosed |