Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 6/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.43 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
| ▸ | MMP7 | P09237 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.37 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.36 |
| ▸ | GCK | P35557 | 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 | |
|---|---|---|---|---|
| SCHEMBL5080882 | 0.83 | SMYD3 (0.50) | LMNATSHROPRD1MEN1CYP3A4 | |
| SCHEMBL5838596 | 0.74 | ADRA2A (0.50) | — | |
| SCHEMBL7519475 | 0.71 | SLC6A2 (0.59) | SLC6A2SLC6A4SLC6A3ADAM17OPRD1 | |
| SCHEMBL5049558 | 0.71 | HTR1E (0.64) | SLC6A2SLC6A3LMNATSHRMEN1 | |
| SCHEMBL6999932 | 0.70 | CCR4 (0.53) | LMNAKMT2A | |
| SCHEMBL5049482 | 0.70 | CYP1A2 (0.63) | SLC6A2SLC6A3LMNATSHRMEN1 | |
| SCHEMBL22491347 | 0.70 | OPRD1 (0.54) | SLC6A2SLC6A4SLC6A3OPRD1SMYD3 | |
| SCHEMBL7084349 | 0.69 | CACNA2D1 (0.47) | TSHRMEN1CYP3A4KMT2A | |
| SCHEMBL6185314 | 0.69 | CCR5 (0.45) | LMNAMEN1KMT2A | |
| SCHEMBL20533700 | 0.69 | CYP46A1 (0.34) | SLC6A2SLC6A4SLC6A3SMYD3 |
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-1368314-A1 | N-4-PIPERIDINYL COMPOUNDS AS CCR5 MODULATORS | AstraZeneca AB (SE) | 2003-12-10 | — | — | EP | disclosed |
| WO-2002070479-A1 | N-4-PIPERIDINYL COMPOUNDS AS CCR5 MODULATORS | ASTRAZENECA AB (SE) | 2002-09-12 | — | — | WO | disclosed |