Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB11 | O95342 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.41 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7086760 | 0.91 | ABCB11 (0.53) | ABCB11KDM4EALDH1A1LMNAHTT | |
| SCHEMBL7088272 | 0.84 | NOD2 (0.47) | ABCB11KDM4EALDH1A1LMNAHTT | |
| SCHEMBL7083180 | 0.84 | ABCB11 (0.52) | ABCB11KDM4EALDH1A1LMNAHTT | |
| SCHEMBL7083764 | 0.81 | ABCB11 (0.57) | ABCB11KDM4EALDH1A1LMNAHTT | |
| SCHEMBL7082918 | 0.80 | CCR2 (0.55) | ABCB11KDM4ELMNAHTTNOD2 | |
| SCHEMBL7597569 | 0.77 | ABCB11 (0.56) | ABCB11KDM4EALDH1A1LMNAHTT | |
| SCHEMBL7084254 | 0.77 | ABCB11 (0.49) | ABCB11KDM4EALDH1A1LMNAHTT | |
| SCHEMBL7086770 | 0.77 | ABCB11 (0.48) | ABCB11KDM4EALDH1A1LMNAHTT | |
| SCHEMBL1397981 | 0.76 | ALOX15 (0.61) | KDM4EALDH1A1HPGDRAB9ANPC1 | |
| SCHEMBL7086985 | 0.74 | CCR2 (0.53) | ABCB11KDM4EALDH1A1LMNAHTT |
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-1252142-A1 | INDOLE DERIVATIVES AS MCP-1 RECEPTOR ANTAGONISTS | AstraZeneca AB (SE) | 2002-10-30 | — | — | EP | disclosed |
| WO-2001051466-A1 | INDOLE DERIVATIVES AS MCP-1 RECEPTOR ANTAGONISTS | ASTRAZENECA AB (SE) | 2001-07-19 | — | — | WO | disclosed |