Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.49 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL6770448 | 1.00 | KMT2A (0.49) | KMT2ALMNAMEN1MAPTMAPK1 | |
| SCHEMBL3600589 | 0.83 | KMT2A (0.44) | KMT2ALMNAMEN1MAPTMAPK1 | |
| SCHEMBL3604983 | 0.83 | KMT2A (0.44) | KMT2ALMNAMEN1MAPTMAPK1 | |
| SCHEMBL3600592 | 0.83 | KMT2A (0.44) | KMT2ALMNAMEN1MAPTMAPK1 | |
| SCHEMBL3604985 | 0.83 | KMT2A (0.44) | KMT2ALMNAMEN1MAPTMAPK1 | |
| SCHEMBL28660052 | 0.80 | ESR1 (0.59) | KMT2ALMNAMEN1MAPTMAPK1 | |
| SCHEMBL6247478 | 0.80 | CYP2A6 (0.41) | MAPTTRPA1ABCB11SIGMAR1CYP2C19 | |
| SCHEMBL1758882 | 0.80 | CYP2A6 (0.41) | MAPTTRPA1ABCB11SIGMAR1CYP2C19 | |
| SCHEMBL1758883 | 0.80 | CYP2A6 (0.41) | MAPTTRPA1ABCB11SIGMAR1CYP2C19 | |
| SCHEMBL14604979 | 0.78 | TRPA1 (0.58) | KMT2ALMNAMEN1MAPTNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6673824-B1 | HYPOTENSIVE AGENTS | BRISTOL-MYERS SQUIBB CO. | 2004-01-06 | — | — | US | disclosed |
| US-6107320-A | Phenyl sulfonamide endothelin antagonists | BRISTOL-MYERS SQUIBB CO. (US) | 2000-08-22 | — | — | US | disclosed |
| US-5514696-A | Phenyl sulfonamide endothelin antagonists | BRISTOL-MYERS SQUIBB CO. (US) | 1996-05-07 | — | — | US | disclosed |