Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.38 |
| ▸ | TUBB | P07437 | 1/20 | 0.38 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.38 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.38 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.38 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.38 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.38 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.38 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.38 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.38 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.38 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.38 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.38 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.38 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7139681 | 0.90 | TSHR (0.36) | KMT2AMEN1KEAP1TSHRTUBB4A | |
| SCHEMBL7528469 | 0.85 | KEAP1 (0.41) | KMT2AMEN1KEAP1NOTUMMAPT | |
| SCHEMBL7704182 | 0.83 | CYP3A4 (0.35) | KMT2AMEN1KEAP1TSHRNOTUM | |
| SCHEMBL6624341 | 0.82 | NOTUM (0.36) | KMT2AMEN1KEAP1NOTUMMAPT | |
| SCHEMBL7704377 | 0.80 | ALDH1A1 (0.45) | KMT2AMEN1MAPTNPC1RAB9A | |
| SCHEMBL7526500 | 0.79 | KEAP1 (0.42) | KMT2AMEN1KEAP1NOTUMMAPT | |
| SCHEMBL7705332 | 0.79 | ABL1 (0.41) | KMT2AMEN1MAPT | |
| SCHEMBL7705335 | 0.78 | ALDH1A1 (0.44) | KMT2AMEN1TSHRMAPTMAPK1 | |
| SCHEMBL5868991 | 0.78 | KEAP1 (0.37) | KEAP1NOTUMSTIM1ORAI1NPC1 | |
| SCHEMBL7139910 | 0.76 | CYP3A4 (0.34) | KEAP1TSHRNOTUMHCRTR2SMN1; SMN2 |
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 |