Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 5/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.54 |
| ▸ | MAOB | P27338 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | USP28 | Q96RU2 | 1/20 | 0.52 |
| ▸ | USP25 | Q9UHP3 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL31644088 | 0.84 | SLC6A4 (0.66) | CCR5SLC6A4MAOBALDH1A1RAB9A | |
| SCHEMBL368071 | 0.84 | SLC6A4 (0.66) | CCR5SLC6A4MAOBALDH1A1RAB9A | |
| SCHEMBL30835101 | 0.82 | RAB9A (0.59) | CCR5SLC6A4MAOBALDH1A1RAB9A | |
| SCHEMBL17049367 | 0.82 | CCR5 (0.56) | CCR5SLC6A4MAOBALDH1A1RAB9A | |
| SCHEMBL7898169 | 0.82 | RAB9A (0.59) | CCR5SLC6A4MAOBALDH1A1RAB9A | |
| SCHEMBL5109981 | 0.79 | FFAR1 (0.56) | CCR5SLC6A4MAOBALDH1A1RAB9A | |
| SCHEMBL3713861 | 0.79 | CCR5 (0.54) | CCR5SLC6A4MAOBALDH1A1RAB9A | |
| SCHEMBL224277 | 0.79 | KDM1A (0.55) | CCR5SLC6A4MAOBALDH1A1RAB9A | |
| SCHEMBL3724105 | 0.79 | MEN1 (0.59) | CCR5SLC6A4MAOBALDH1A1RAB9A | |
| SCHEMBL2384629 | 0.79 | USP28 (0.56) | CCR5SLC6A4MAOBALDH1A1RAB9A |
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-1797110-A1 | ANTIBACTERIAL AMIDE MACROCYCLES IV | AiCuris GmbH & Co. KG (DE) | 2007-06-20 | — | — | EP | disclosed |
| WO-2006034786-A1 | ANTIBACTERIAL AMIDE MACROCYCLES IV | AICURIS GMBH & CO.KG (DE) | 2006-04-06 | — | — | WO | disclosed |
| WO-2005033129-A1 | ANTIBACTERIAL AMIDE MACROCYCLES | BAYER HEALTHCARE AG (DE) | 2005-04-14 | — | — | WO | disclosed |