Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 6/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.47 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 3/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.45 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6880135 | 1.00 | SIGMAR1 (0.52) | SIGMAR1MAPTLMNAKDM4EALDH1A1 | |
| SCHEMBL6880935 | 0.92 | ADRA2A (0.47) | SIGMAR1MAPTLMNAKDM4EADRA2A | |
| SCHEMBL6880943 | 0.92 | ADRA2A (0.47) | SIGMAR1MAPTLMNAKDM4EADRA2A | |
| SCHEMBL6457835 | 0.90 | ALDH1A1 (0.47) | MAPTLMNAKDM4EALDH1A1ADRA2A | |
| SCHEMBL6457820 | 0.90 | ALDH1A1 (0.47) | MAPTLMNAKDM4EALDH1A1ADRA2A | |
| SCHEMBL6461805 | 0.87 | IGF1R (0.54) | MAPTLMNAKDM4EALDH1A1POLB | |
| SCHEMBL6461800 | 0.87 | IGF1R (0.54) | MAPTLMNAKDM4EALDH1A1POLB | |
| SCHEMBL6467397 | 0.85 | MAPT (0.45) | MAPTLMNAPOLBADRA2AMCHR1 | |
| SCHEMBL6880545 | 0.85 | MAPT (0.54) | MAPTPOLBADRA2AMCHR1KDR | |
| SCHEMBL6880550 | 0.85 | MAPT (0.54) | MAPTPOLBADRA2AMCHR1KDR |
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 |