Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.47 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.46 |
| ▸ | CDK9 | P50750 | 2/20 | 0.46 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | CCR1 | P32246 | 1/20 | 0.40 |
| ▸ | CCR5 | P51681 | 1/20 | 0.40 |
| ▸ | CCR8 | P51685 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4013308 | 0.89 | HTR1A (0.47) | NR1H2NR1H3SMN1; SMN2CCNT1CDK9 | |
| SCHEMBL4013857 | 0.86 | NR1H2 (0.47) | NR1H2NR1H3CCNT1CDK9ALOX15 | |
| SCHEMBL4011959 | 0.85 | LRRK2 (0.42) | NR1H2NR1H3CCNT1CDK9ALDH1A1 | |
| SCHEMBL4011482 | 0.84 | NR1H2 (0.47) | NR1H2NR1H3HTTCCNT1CDK9 | |
| SCHEMBL2449164 | 0.80 | HSP90AA1 (0.43) | SMN1; SMN2HTTHSD17B10ALDH1A1KDM4E | |
| SCHEMBL4013124 | 0.80 | NR4A2 (0.51) | SMN1; SMN2HTTNR4A2HSP90AA1HSP90AB1 | |
| SCHEMBL4012080 | 0.79 | NR1H2 (0.47) | NR1H2NR1H3SMN1; SMN2NR4A2ALDH1A1 | |
| SCHEMBL4020515 | 0.79 | NR1H2 (0.78) | NR1H2NR1H3 | |
| SCHEMBL4011946 | 0.78 | NR4A2 (0.49) | NR1H2NR1H3SMN1; SMN2HTTHSD17B10 | |
| SCHEMBL4018332 | 0.77 | NR1H2 (0.63) | NR1H2NR1H3 |
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-2074098-A2 | QUINOLINE COMPOUNDS | Wyeth (US) | 2009-07-01 | — | — | EP | disclosed |
| WO-2008049047-A2 | QUINOLINE COMPOUNDS | WYETH (US) | 2008-04-24 | — | — | WO | disclosed |