Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.56 |
| ▸ | CLEC4M | Q9H2X3 | 1/20 | 0.55 |
| ▸ | CNR2 | P34972 | 2/20 | 0.48 |
| ▸ | CNR1 | P21554 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2971885 | 0.88 | ALDH1A1 (0.73) | ALDH1A1KDM4EHPGDCLEC4MCNR2 | |
| SCHEMBL6204974 | 0.80 | POLB (0.64) | ALDH1A1KDM4EHPGDMEN1KMT2A | |
| SCHEMBL6205058 | 0.78 | POLB (0.62) | ALDH1A1KDM4EHPGDCLEC4MCNR2 | |
| SCHEMBL17424085 | 0.78 | CNR2 (0.55) | ALDH1A1KDM4EHPGDCLEC4MCNR2 | |
| SCHEMBL6204607 | 0.78 | ALDH1A1 (0.75) | ALDH1A1KDM4EHPGDCNR2CNR1 | |
| SCHEMBL5133700 | 0.78 | CLEC4M (0.71) | ALDH1A1KDM4EHPGDCLEC4MCNR2 | |
| SCHEMBL10878556 | 0.78 | CLEC4M (0.71) | ALDH1A1KDM4EHPGDCLEC4MCNR2 | |
| SCHEMBL6206536 | 0.77 | ALDH1A1 (0.77) | ALDH1A1KDM4EHPGDCNR2CNR1 | |
| SCHEMBL6205750 | 0.76 | ALDH1A1 (0.81) | ALDH1A1KDM4EHPGDCLEC4MCNR2 | |
| SCHEMBL6204593 | 0.76 | ALDH1A1 (0.56) | ALDH1A1KDM4EHPGDCNR2CNR1 |
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-1177177-B1 | SUBSTITUTED 4-OXO-QUINOLINE-3-CARBOXAMIDES: GABA BRAIN RECEPTOR LIGANDS | NEUROGEN CORP (US) | 2005-02-23 | — | — | EP | claimed |