Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.64 |
| ▸ | HTR2B | P41595 | 5/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | HTR2A | P28223 | 6/20 | 0.57 |
| ▸ | HTR2C | P28335 | 5/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | HTR1A | P08908 | 3/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.57 |
| ▸ | HTR1D | P28221 | 2/20 | 0.57 |
| ▸ | HTR1B | P28222 | 2/20 | 0.57 |
| ▸ | HTR7 | P34969 | 2/20 | 0.57 |
| ▸ | HTR6 | P50406 | 2/20 | 0.57 |
| ▸ | HTR4 | Q13639 | 2/20 | 0.57 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.57 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.57 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL434877 | 1.00 | GPR84 (0.64) | GPR84HTR2BCYP1A2ALDH1A1CYP2C19 | |
| SCHEMBL1120777 | 0.85 | KDM4E (0.60) | GPR84HTR2BCYP1A2ALDH1A1CYP2C19 | |
| SCHEMBL5432612 | 0.82 | GPR84 (0.66) | GPR84HTR2BCYP1A2ALDH1A1CYP2C19 | |
| SCHEMBL3629976 | 0.81 | HTR2B (0.65) | GPR84HTR2BCYP1A2ALDH1A1CYP2C19 | |
| SCHEMBL28337310 | 0.81 | GPR84 (0.64) | GPR84HTR2BCYP1A2ALDH1A1CYP2C19 | |
| SCHEMBL23259474 | 0.80 | HTR1B (0.52) | GPR84HTR2BCYP1A2CYP2C19HTR2A | |
| SCHEMBL6290566 | 0.79 | GPR84 (0.62) | GPR84HTR2BCYP1A2ALDH1A1CYP2C19 | |
| SCHEMBL21256024 | 0.79 | GPR84 (0.62) | GPR84HTR2BCYP1A2ALDH1A1CYP2C19 | |
| SCHEMBL21623872 | 0.79 | GPR84 (0.62) | GPR84HTR2BCYP1A2ALDH1A1CYP2C19 | |
| SCHEMBL4475932 | 0.79 | GPR84 (0.62) | GPR84HTR2BCYP1A2ALDH1A1CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-8138187-B2 | Substituted heteroaryl derivatives | GRUENENTHAL GMBH (DE) | 2012-03-20 | — | — | US | disclosed |