Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.35 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.35 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.35 |
| ▸ | TDP2 | O95551 | 1/20 | 0.34 |
| ▸ | KDM6B | O15054 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7528469 | 0.90 | KEAP1 (0.41) | KEAP1RAB9ANPC1NOTUMKDM4E | |
| SCHEMBL5869106 | 0.87 | CYP17A1 (0.41) | KEAP1RAB9ANPC1NOTUMHDAC2 | |
| SCHEMBL7705397 | 0.79 | KMT2A (0.40) | KEAP1RAB9ANPC1NOTUMMEN1 | |
| SCHEMBL5868991 | 0.79 | KEAP1 (0.37) | KEAP1RAB9ANPC1NOTUM | |
| SCHEMBL5868803 | 0.79 | KEAP1 (0.37) | KEAP1RAB9ANPC1NOTUM | |
| SCHEMBL6689698 | 0.77 | L3MBTL1 (0.41) | KEAP1NOTUMMEN1KMT2AALDH1A1 | |
| SCHEMBL5869003 | 0.77 | NPC1 (0.48) | RAB9ANPC1KDM4EMEN1KMT2A | |
| SCHEMBL5868947 | 0.77 | KCNQ4 (0.40) | KEAP1RAB9ANPC1NOTUMMEN1 | |
| SCHEMBL5868872 | 0.77 | CYP3A4 (0.40) | KEAP1NOTUMMEN1KMT2AALDH1A1 | |
| SCHEMBL5868820 | 0.76 | CYP17A1 (0.37) | KEAP1NOTUMMEN1KMT2AALDH1A1 |
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-1224175-A2 | BENZODIAZEPINE DERIVATIVES AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2002-07-24 | — | — | EP | disclosed |
| WO-2001029012-A2 | BENZODIAZEPINE DERIVATIVES AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2001-04-26 | — | — | WO | disclosed |