Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.47 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.46 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.46 |
| ▸ | PTGDR2 | Q9Y5Y4 | 5/20 | 0.44 |
| ▸ | CNR2 | P34972 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | HRH2 | P25021 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | HTR1B | P28222 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | HTR1E | P28566 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14067788 | 0.90 | HDAC6 (0.46) | SIGMAR1CNR2ALDH1A1HDAC1HDAC6 | |
| SCHEMBL14067789 | 0.87 | TMEM97 (0.45) | TMEM97SIGMAR1AKR1B10AKR1B1PTGDR2 | |
| SCHEMBL14067833 | 0.83 | HDAC1 (0.49) | AKR1B10AKR1B1PTGDR2KDM4EHDAC1 | |
| SCHEMBL14067942 | 0.81 | HRH1 (0.46) | CNR2HDAC1HDAC6CHRM5HRH1 | |
| SCHEMBL14067970 | 0.81 | HDAC1 (0.40) | CNR2KDM4EALDH1A1HDAC1HDAC6 | |
| SCHEMBL14067777 | 0.81 | HDAC6 (0.47) | PTGDR2KDM4EALDH1A1HDAC1HDAC6 | |
| SCHEMBL14067957 | 0.78 | HDAC1 (0.60) | TMEM97SIGMAR1AKR1B10AKR1B1PTGDR2 | |
| SCHEMBL14067791 | 0.77 | HDAC1 (0.44) | CNR2ALDH1A1HDAC1HDAC6HDAC10 | |
| SCHEMBL14067786 | 0.76 | AKR1B10 (0.55) | AKR1B10AKR1B1PTGDR2CNR2HRH1 | |
| SCHEMBL23148492 | 0.75 | PTGDR2 (0.59) | AKR1B10AKR1B1PTGDR2HDAC1HDAC6 |
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-2008115098-A2 | SUBSTITUTED 2,3,4,5-TETRAHYDRO-1H-PYRIDO[4,3-B]INDOLES, METHODS FOR THE PRODUCTION AND THE USE THEREOF | ALLA CHEM, LLC (US) | 2008-09-25 | — | — | WO | disclosed |