Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.45 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 3/20 | 0.43 |
| ▸ | MCHR1 | Q99705 | 5/20 | 0.43 |
| ▸ | CNR2 | P34972 | 2/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.41 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.41 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL6868191 | 1.00 | P2RX7 (0.45) | P2RX7KLKB1NPSR1HDAC1HDAC2 | |
| SCHEMBL6460488 | 0.90 | CNR1 (0.53) | KLKB1NPSR1HDAC1HDAC2CNR1 | |
| SCHEMBL6460482 | 0.90 | CNR1 (0.53) | KLKB1NPSR1HDAC1HDAC2CNR1 | |
| SCHEMBL13793586 | 0.85 | MCHR1 (0.58) | P2RX7MCHR1ADRA2ANPY5R | |
| SCHEMBL6868628 | 0.82 | ADRA2A (0.46) | P2RX7KLKB1CNR1MCHR1CNR2 | |
| SCHEMBL6868622 | 0.82 | ADRA2A (0.46) | P2RX7KLKB1CNR1MCHR1CNR2 | |
| SCHEMBL6873537 | 0.81 | KLKB1 (0.46) | P2RX7KLKB1NPSR1HDAC1HDAC2 | |
| SCHEMBL6873542 | 0.81 | KLKB1 (0.46) | P2RX7KLKB1NPSR1HDAC1HDAC2 | |
| SCHEMBL6458724 | 0.81 | MCHR1 (0.45) | MCHR1ADRA2ANPY5RMAPK8MAPK9 | |
| SCHEMBL6458733 | 0.81 | MCHR1 (0.45) | MCHR1ADRA2ANPY5RMAPK8MAPK9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1464335-A2 | Quinoline, tetrahydroquinoline and pyrimidine derivatives as mch antagonist | Taisho Pharmaceutical Co. Ltd. (JP) | 2004-10-06 | — | — | EP | disclosed |