Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | ATP4A | P20648 | 1/20 | 0.38 |
| ▸ | ATP4B | P51164 | 1/20 | 0.38 |
| ▸ | IDH1 | O75874 | 2/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5044496 | 0.94 | ATP4A (0.37) | MAPTATP4AATP4BTP53 | |
| SCHEMBL5047889 | 0.93 | MGLL (0.36) | MAPTNPC1POLBRAB9AHTR2A | |
| SCHEMBL5040330 | 0.92 | NTMT1 (0.40) | NPC1HTTRAB9ASMN1; SMN2CNR1 | |
| SCHEMBL5048696 | 0.92 | CDC25A (0.43) | MAPTKDM4ENPC1ALDH1A1HPGD | |
| SCHEMBL5047174 | 0.91 | CNR1 (0.40) | MAPTHTR2AHTR2CSLC6A4CNR1 | |
| SCHEMBL5039575 | 0.90 | AR (0.43) | MAPTALDH1A1POLBRAB9ASLC6A4 | |
| SCHEMBL5044042 | 0.90 | CDC25A (0.42) | MAPTKDM4ENPC1ALDH1A1HTT | |
| SCHEMBL5047923 | 0.88 | ATP4A (0.38) | MAPTHTTATP4AATP4BTP53 | |
| SCHEMBL5047653 | 0.88 | ATP4A (0.38) | MAPTATP4AATP4BTP53 | |
| SCHEMBL5049183 | 0.88 | NPC1 (0.40) | MAPTKDM4ENPC1ALDH1A1HPGD |
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-1583762-B1 | PYRROLYL-THIAZOLES AND THEIR USE AS CB 1 RECEPTOR INVERSE AGONISTS | HOFFMANN LA ROCHE (CH) | 2008-07-09 | — | — | EP | claimed |