Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 5/20 | 0.42 |
| ▸ | ABCC1 | P33527 | 4/20 | 0.42 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | BCL9 | O00512 | 2/20 | 0.39 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7146551 | 0.87 | ABCB1 (0.39) | ALDH1A1MAPTKDM4EABCB1ABCC1 | |
| SCHEMBL7698560 | 0.83 | DHODH (0.38) | ALDH1A1MAPTABCB1ABCC1MEN1 | |
| SCHEMBL7145942 | 0.79 | KCNQ4 (0.36) | ALDH1A1MAPTKDM4EABCB1ABCC1 | |
| SCHEMBL7467490 | 0.76 | ABCB1 (0.46) | ALDH1A1MAPTABCB1ABCC1MEN1 | |
| SCHEMBL7139923 | 0.74 | ALDH1A1 (0.40) | ALDH1A1MAPTABCB1ABCC1HTT | |
| SCHEMBL7703599 | 0.74 | ABCB1 (0.44) | ALDH1A1MAPTABCB1ABCC1HTT | |
| SCHEMBL17728882 | 0.74 | RAB9A (0.57) | ALDH1A1MAPTHCAR3MEN1LMNA | |
| SCHEMBL17728883 | 0.74 | RAB9A (0.57) | ALDH1A1MAPTHCAR3MEN1LMNA | |
| SCHEMBL7138373 | 0.74 | ABCB1 (0.47) | ALDH1A1MAPTABCB1ABCC1HTT | |
| SCHEMBL7142774 | 0.73 | KCNQ4 (0.38) | ALDH1A1MAPTABCB1ABCC1 |
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-1224174-A2 | BENZODIAZEPINE DERIVATIVES AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2002-07-24 | — | — | EP | disclosed |
| WO-2001029011-A2 | BENZODIAZEPINE DERIVATIVES AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2001-04-26 | — | — | WO | disclosed |