Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TERT | O14746 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.35 |
| ▸ | RELA | Q04206 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7806544 | 0.87 | CCR1 (0.44) | CCR1ALDH1A1TERTNPC1RAB9A | |
| SCHEMBL13739830 | 0.81 | CCR1 (0.39) | CCR1ALDH1A1RAB9ALMNAL3MBTL1 | |
| SCHEMBL4050836 | 0.80 | NPC1 (0.35) | ALDH1A1NPC1RAB9AKDM4ENFKB1 | |
| SCHEMBL2169969 | 0.80 | CCR1 (0.48) | CCR1ALDH1A1TERTNPC1RAB9A | |
| SCHEMBL1914989 | 0.78 | BACE1 (0.53) | CCR1ALDH1A1TERTNPC1RAB9A | |
| SCHEMBL13738538 | 0.78 | ALDH1A1 (0.40) | CCR1ALDH1A1NPC1RAB9AKDM4E | |
| SCHEMBL8629268 | 0.78 | NPC1 (0.51) | ALDH1A1NPC1RAB9AKDM4ENFKB1 | |
| SCHEMBL8629269 | 0.78 | NPC1 (0.51) | ALDH1A1NPC1RAB9AKDM4ENFKB1 | |
| SCHEMBL13738324 | 0.78 | CYP1A2 (0.38) | CCR1ALDH1A1MAPT | |
| SCHEMBL10974039 | 0.76 | CYP1A2 (0.49) | CCR1ALDH1A1TERTNPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004065389-A1 | PYRROLOPYRIMIDINE DERIVATIVES USEFUL AS MODULATORS OF MULTIDRUG RESISTANCE | XENOVA LIMITED (GB) | 2004-08-05 | — | — | WO | disclosed |