Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | GUSB | P08236 | 4/20 | 0.47 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.45 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.42 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.42 |
| ▸ | MDH2 | P40926 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | GABRP | O00591 | 1/20 | 0.41 |
| ▸ | GABRD | O14764 | 1/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4649998 | 0.89 | RAB9A (0.41) | ALDH1A1HPGDKDM4ELMNAGABRA1 | |
| SCHEMBL4650809 | 0.88 | PRKAB2 (0.47) | ALDH1A1HPGDKDM4EGUSBKDM5B | |
| SCHEMBL4650110 | 0.88 | KDM5A (0.42) | ALDH1A1HPGDKDM4EKDM4CKDM5B | |
| SCHEMBL4649447 | 0.85 | RAB9A (0.49) | ALDH1A1HPGDKDM4ELMNAGABRA1 | |
| SCHEMBL4650041 | 0.83 | ALDH1A1 (0.47) | ALDH1A1HPGDKDM4EKDM5BLMNA | |
| SCHEMBL4650022 | 0.82 | ALDH1A1 (0.50) | ALDH1A1HPGDKDM4ELMNAGABRA1 | |
| SCHEMBL4650046 | 0.81 | RAB9A (0.47) | ALDH1A1HPGDKDM4EGUSBLMNA | |
| SCHEMBL4650793 | 0.81 | ALDH1A1 (0.46) | ALDH1A1HPGDKDM4ELMNAGABRA1 | |
| SCHEMBL4650011 | 0.80 | KDM4C (0.45) | ALDH1A1HPGDKDM4EGUSBKDM4C | |
| SCHEMBL4650045 | 0.80 | ALDH1A1 (0.46) | ALDH1A1HPGDKDM4EGUSBLMNA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1963271-A1 | QUINOLONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS | Merck & Co., Inc. (US) | 2008-09-03 | — | — | EP | claimed |
| WO-2007067489-A1 | QUINOLONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS | MERCK & CO., INC. (US) | 2007-06-14 | — | — | WO | claimed |
| EP-1963271-A1 | QUINOLONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS | Merck & Co., Inc. (US) | 2008-09-03 | — | — | EP | disclosed |
| WO-2007067489-A1 | QUINOLONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS | MERCK & CO., INC. (US) | 2007-06-14 | — | — | WO | disclosed |