Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
| ▸ | SLC18A3 | Q16572 | 3/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
| ▸ | OGFRL1 | Q5TC84 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL446831 | 0.87 | LTA4H (0.42) | LTA4HSLC18A3SIGMAR1GRIN2BKDM4E | |
| SCHEMBL447088 | 0.76 | LTA4H (0.72) | LTA4HSLC18A3CYP2D6CYP2C19SIGMAR1 | |
| SCHEMBL4600001 | 0.72 | AKR1C3 (0.44) | SLC18A3CYP2C19SIGMAR1KDM4ENPC1 | |
| SCHEMBL14117526 | 0.72 | AKR1C3 (0.44) | SLC18A3CYP2C19SIGMAR1KDM4ENPC1 | |
| SCHEMBL444560 | 0.70 | AKR1C3 (0.56) | LTA4HSLC18A3CYP2D6CYP2C19SIGMAR1 | |
| SCHEMBL5007409 | 0.70 | AKR1C3 (0.51) | LTA4HCYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL6937542 | 0.66 | GRM4 (0.49) | CYP2C19 | |
| SCHEMBL1587410 | 0.66 | AKR1C3 (0.54) | SLC18A3GRIN2BNPC1RAB9A | |
| SCHEMBL447356 | 0.66 | SLC18A3 (0.50) | LTA4HSLC18A3CYP2D6CYP2C19SIGMAR1 | |
| SCHEMBL1867197 | 0.66 | CCR2 (0.54) | SLC18A3CYP2D6CYP2C19SIGMAR1GRIN2B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2155716-A2 | SUBSTITUTED HETEROCYCLIC DERIVATIVES AND COMPOSITIONS AND THEIR PHARMACEUTICAL USE AS ANTIBACTERIALS | Pfizer Inc. (US) | 2010-02-24 | — | — | EP | disclosed |
| WO-2008139288-A2 | SUBSTITUTED HETEROCYCLIC DERIVATIVES AND COMPOSITIONS AND THEIR PHARMACEUTICAL USE AS ANTIBACTERIALS | PFIZER INC. (US) | 2008-11-20 | — | — | WO | disclosed |