Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRNP | P04156 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.46 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | MYC | P01106 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | RECQL | P46063 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL27785956 | 0.81 | MYC (0.50) | KDM4CL3MBTL1ALDH1A1ALOX15MYC | |
| SCHEMBL7075388 | 0.79 | ALDH1A1 (0.48) | L3MBTL1ALDH1A1ALOX15MEN1MAPT | |
| SCHEMBL14398948 | 0.78 | ALDH1A1 (0.45) | ALDH1A1MYCMEN1KMT2ANR4A1 | |
| SCHEMBL14398980 | 0.78 | PTGS1 (0.43) | RXFP1L3MBTL1ALDH1A1MEN1MAPT | |
| SCHEMBL27725578 | 0.78 | ALDH1A1 (0.45) | NPSR1L3MBTL1ALDH1A1ALOX15MYC | |
| SCHEMBL12006047 | 0.78 | MYC (0.54) | PRNPPPARGNPSR1RXFP1NCOR2 | |
| SCHEMBL14398893 | 0.78 | PRNP (0.47) | PRNPPPARGNPSR1RXFP1NCOR2 | |
| SCHEMBL9223049 | 0.78 | CYP3A4 (0.60) | KDM4CL3MBTL1ALDH1A1ALOX15MYC | |
| SCHEMBL7070868 | 0.78 | DHODH (0.51) | L3MBTL1ALDH1A1KMT2ATDP1HPGD | |
| SCHEMBL28947795 | 0.77 | PTPRC (0.48) | L3MBTL1ALDH1A1ALOX15MYCKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007117180-A1 | AZAHETEROCYCLES, COMBINATORY LIBRARY, FOCUSED LIBRARY, PHARMACEUTICAL COMPOSITION AND METHODS FOR THE PRODUCTION THEREOF | 'CHEMICAL DIVERSITY RESEARCH INSTITUTE' LTD. (RU) | 2007-10-18 | — | — | WO | disclosed |