Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NSD2 | O96028 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | TGM2 | P21980 | 2/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 3/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.33 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.33 |
| ▸ | AHR | P35869 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7483462 | 1.00 | NSD2 (0.42) | NSD2BCHEDAOCES1TGM2 | |
| SCHEMBL7472238 | 1.00 | NSD2 (0.42) | NSD2BCHEDAOCES1TGM2 | |
| SCHEMBL7477188 | 0.75 | NSD2 (0.53) | NSD2BCHEDAOCES1TGM2 | |
| SCHEMBL8697033 | 0.73 | TGM2 (0.42) | CES1TGM2MAPT | |
| SCHEMBL8693444 | 0.73 | TGM2 (0.42) | CES1TGM2MAPT | |
| SCHEMBL8696547 | 0.73 | TGM2 (0.42) | CES1TGM2MAPT | |
| SCHEMBL7484503 | 0.68 | NSD2 (0.49) | NSD2BCHEDAOCES1TGM2 | |
| SCHEMBL2269040 | 0.68 | PDK2 (0.61) | NSD2BCHEDAOCES1TGM2 | |
| SCHEMBL25112387 | 0.63 | CES1 (0.77) | NSD2BCHEDAOCES1TGM2 | |
| SCHEMBL8303270 | 0.61 | NSD2 (0.47) | NSD2BCHEDAOCES1TGM2 |
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-0697405-B1 | Substituted quinoline derivatives, process for their preparation and their use | AVENTIS PHARMA GMBH (DE) | 2002-08-14 | — | — | EP | disclosed |
| EP-0697405-A1 | Substituted quinoline derivatives, process for their preparation and their use | HOECHST AKTIENGESELLSCHAFT (DE) | 1996-02-21 | — | — | EP | disclosed |