Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 1/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | HTR1D | P28221 | 1/20 | 0.42 |
| ▸ | HTR1B | P28222 | 1/20 | 0.42 |
| ▸ | MPO | P05164 | 1/20 | 0.37 |
| ▸ | TPO | P07202 | 1/20 | 0.37 |
| ▸ | AHR | P35869 | 1/20 | 0.36 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | JAK1 | P23458 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13284394 | 0.85 | DRD4 (0.50) | DRD4HTR1AHTR1DHTR1BMPO | |
| SCHEMBL16242410 | 0.70 | FAAH (0.46) | AHRALDH1A1 | |
| SCHEMBL23932511 | 0.69 | HTR1A (0.47) | DRD4HTR1AHTR1DHTR1BALDH1A1 | |
| SCHEMBL13356639 | 0.68 | DRD4 (0.41) | DRD4HTR1AHTR1DHTR1BMPO | |
| SCHEMBL4402791 | 0.67 | AHR (0.46) | AHRHTR2AHTR2CKEAP1 | |
| SCHEMBL13284775 | 0.67 | DRD4 (0.70) | DRD4HTR1AHTR1DHTR1B | |
| SCHEMBL22603988 | 0.66 | HTT (0.49) | HTR1AMPOTPOALDH1A1KDM4E | |
| SCHEMBL1808667 | 0.65 | SIGMAR1 (0.57) | DRD4ALDH1A1KDM4EPOLB | |
| SCHEMBL22619011 | 0.65 | DRD2 (0.53) | DRD4HTR1A | |
| SCHEMBL593512 | 0.65 | AHR (0.50) | AHRKEAP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102015683-A | Substituted indole derivatives | GRUENENTHAL GMBH | 2011-04-13 | — | — | CN | claimed |
| CN-102015683-A | Substituted indole derivatives | GRUENENTHAL GMBH | 2011-04-13 | — | — | CN | disclosed |