Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 2/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.38 |
| ▸ | ESRRG | P62508 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ATG4B | Q9Y4P1 | 8/20 | 0.34 |
| ▸ | PLA2G1B | P04054 | 7/20 | 0.34 |
| ▸ | LTB4R | Q15722 | 2/20 | 0.34 |
| ▸ | LTB4R2 | Q9NPC1 | 2/20 | 0.34 |
| ▸ | GLI1 | P08151 | 1/20 | 0.34 |
| ▸ | GLI2 | P10070 | 1/20 | 0.34 |
| ▸ | THRA | P10827 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6446460 | 1.00 | OPRM1 (0.38) | OPRM1OPRD1OPRK1ESRRGKDM4E | |
| SCHEMBL6822577 | 0.90 | LTB4R (0.43) | ALDH1A1MAPTKMT2ALTB4RLTB4R2 | |
| SCHEMBL6822576 | 0.90 | LTB4R (0.43) | ALDH1A1MAPTKMT2ALTB4RLTB4R2 | |
| SCHEMBL6446747 | 0.85 | ATG4B (0.35) | OPRM1OPRD1OPRK1ALDH1A1MAPT | |
| SCHEMBL6446750 | 0.85 | ATG4B (0.35) | OPRM1OPRD1OPRK1ALDH1A1MAPT | |
| SCHEMBL6443833 | 0.82 | SIGMAR1 (0.41) | LTB4RLTB4R2CYP1A2 | |
| SCHEMBL6443830 | 0.82 | SIGMAR1 (0.41) | LTB4RLTB4R2CYP1A2 | |
| SCHEMBL6446222 | 0.76 | ZDHHC20 (0.37) | KMT2A | |
| SCHEMBL6446217 | 0.76 | ZDHHC20 (0.37) | KMT2A | |
| SCHEMBL6445379 | 0.75 | ALDH1A1 (0.39) | ALDH1A1MAPTKMT2ALTB4RLTB4R2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1575903-A1 | COMPOUNDS FOR THE INHIBITION OF ROTAMASES | Jerini AG (DE) | 2005-09-21 | — | — | EP | claimed |
| WO-2004065353-A1 | COMPOUNDS FOR THE INHIBITION OF ROTAMASES | JERINI AG (DE) | 2004-08-05 | — | — | WO | claimed |
| WO-2004056755-A2 | COMPOUNDS FOR THE INHIBITION OF NON-PROTEOLYTIC ENZYMES | JERENI AG (DE) | 2004-07-08 | — | — | WO | claimed |