Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 7/20 | 0.57 |
| ▸ | MEN1 | O00255 | 4/20 | 0.49 |
| ▸ | EDNRA | P25101 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | GFER | P55789 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | GPR55 | Q9Y2T6 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.44 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | HTR6 | P50406 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 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 | |
|---|---|---|---|---|
| SCHEMBL7841290 | 0.90 | RAB9A (0.46) | KMT2AMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL7831716 | 0.88 | RAB9A (0.44) | KMT2AMEN1MAPTALDH1A1NPC1 | |
| SCHEMBL7839027 | 0.88 | KDM4E (0.49) | MAPTALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL7842489 | 0.88 | RAB9A (0.44) | KMT2AMEN1MAPTALDH1A1NPC1 | |
| SCHEMBL7839729 | 0.87 | TP53 (0.44) | KMT2AMEN1MAPTALDH1A1NPC1 | |
| SCHEMBL7838582 | 0.87 | MAPT (0.55) | KMT2AMEN1MAPTALDH1A1NPC1 | |
| SCHEMBL7844615 | 0.86 | TP53 (0.46) | KMT2AMEN1MAPTALDH1A1NPC1 | |
| SCHEMBL7845530 | 0.86 | KMT2A (0.43) | KMT2AMEN1EDNRAMAPTALDH1A1 | |
| SCHEMBL27378630 | 0.86 | CYP3A4 (0.43) | KMT2AMEN1MAPTALDH1A1NPC1 | |
| SCHEMBL7842082 | 0.86 | NPC1 (0.44) | KMT2AMAPTALDH1A1NPC1RAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1072660-C | 2,1,3-benzothia (oxa) diazole derivatives having an endothelin receptor antagonistic effect | MERCK PATENT GMBH (DE) | 2001-10-10 | — | — | CN | disclosed |
| US-6017939-A | 2,1,3-benzothia(OXA)diazole derivatives having an endothelin receptor antagonistic effect | MERCK PATENT GESELLSCHAFT (DE) | 2000-01-25 | — | — | US | disclosed |
| CN-1216540-A | 2,1,3-benzothia (oxa) diazole derivatives having an endothelin receptor antagonistic effect | MERCK PATENT GES MIT BESCHRIKT (DE) | 1999-05-12 | — | — | CN | disclosed |