Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 5/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.41 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.41 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL9023447 | 0.78 | HSD17B14 (0.40) | TP53ALDH1A1MAPTGAAKDM4E | |
| SCHEMBL9337154 | 0.78 | IRAK4 (0.45) | IRAK4CES2CES1TP53ALDH1A1 | |
| SCHEMBL14880709 | 0.75 | CES2 (0.69) | CES2CES1TP53ALDH1A1TSHR | |
| SCHEMBL16395918 | 0.71 | TP53 (0.66) | CES2CES1TP53ALDH1A1TSHR | |
| SCHEMBL7101629 | 0.69 | CES2 (0.49) | CES2CES1TP53ALDH1A1TSHR | |
| SCHEMBL9335203 | 0.69 | UNG (0.40) | ALDH1A1MAPTKDM4EKMT2APOLB | |
| SCHEMBL9126277 | 0.67 | CES1 (0.77) | CES2CES1TP53ALDH1A1TSHR | |
| SCHEMBL7785000 | 0.67 | CES2 (0.62) | CES2CES1TP53ALDH1A1TSHR | |
| SCHEMBL29990470 | 0.67 | TSHR (0.70) | CES2CES1TP53ALDH1A1TSHR | |
| SCHEMBL248013 | 0.67 | TSHR (0.70) | CES2CES1TP53ALDH1A1TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0725063-A1 | Quinoline derivatives | CIBA-GEIGY AG (CH) | 1996-08-07 | — | — | EP | disclosed |