Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB11 | O95342 | 3/20 | 0.77 |
| ▸ | CCR2 | P41597 | 7/20 | 0.59 |
| ▸ | MAPT | P10636 | 7/20 | 0.53 |
| ▸ | PKM | P14618 | 4/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 5/20 | 0.52 |
| ▸ | GAA | P10253 | 5/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7592778 | 0.89 | ABCB11 (0.61) | ABCB11CCR2MAPTPKMKDM4E | |
| SCHEMBL6599243 | 0.87 | ABCB11 (1.00) | ABCB11CCR2MAPTPKMGAA | |
| SCHEMBL6598438 | 0.85 | ABCB11 (0.59) | ABCB11CCR2MAPTPKMKDM4E | |
| SCHEMBL21465462 | 0.83 | ABCB11 (0.52) | ABCB11CCR2MAPTPKMKDM4E | |
| SCHEMBL21465479 | 0.81 | ABCB11 (0.67) | ABCB11CCR2MAPTPKMLMNA | |
| SCHEMBL5216231 | 0.81 | ABCB11 (0.52) | ABCB11CCR2MAPTPKMKDM4E | |
| SCHEMBL5214261 | 0.80 | ABCB11 (0.51) | ABCB11CCR2MAPTPKMKDM4E | |
| SCHEMBL6598122 | 0.77 | ABCB11 (0.74) | ABCB11CCR2MAPTPKMGAA | |
| SCHEMBL6300631 | 0.77 | CCR2 (0.52) | ABCB11CCR2MAPTPKMKDM4E | |
| SCHEMBL5213680 | 0.77 | CCR2 (0.65) | ABCB11CCR2MAPTPKMKDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1150952-B1 | INDOLE DERIVATIVES AND THEIR USE AS MCP-1 RECEPTOR ANTAGONISTS | ASTRAZENECA AB (SE) | 2004-10-27 | — | — | EP | disclosed |
| US-6737435-B1 | ANTIINFLAMMATORY AGENTS; MONOCYTE CHEMOATTRACTANT PROTEIN-1 (MCP-1) DISEASES | ASTRAZENECA AB (SE) | 2004-05-18 | — | — | US | disclosed |
| EP-1150952-A1 | INDOLE DERIVATIVES AND THEIR USE AS MCP-1 RECEPTOR ANTAGONISTS | AstraZeneca AB (SE) | 2001-11-07 | — | — | EP | disclosed |
| WO-2000046196-A1 | INDOLE DERIVATIVES AND THEIR USE AS MCP-1 ANTAGONISTS | ASTRAZENECA AB (SE) | 2000-08-10 | — | — | WO | disclosed |