Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5725232 | 0.86 | KDM4E (0.33) | KDM4EMEN1NPC1KMT2A | |
| SCHEMBL5725226 | 0.86 | KDM4E (0.33) | KDM4EMEN1NPC1KMT2A | |
| SCHEMBL8790520 | 0.81 | TBXA2R (0.33) | — | |
| SCHEMBL5725511 | 0.81 | TBXA2R (0.33) | — | |
| SCHEMBL5725809 | 0.79 | DHODH (0.35) | MEN1NPC1KMT2A | |
| SCHEMBL5725812 | 0.79 | DHODH (0.35) | MEN1NPC1KMT2A | |
| SCHEMBL5724732 | 0.78 | DHODH (0.34) | MEN1NPC1KMT2A | |
| SCHEMBL5727815 | 0.74 | HTR2A (0.37) | SLC18A3 | |
| SCHEMBL8790642 | 0.69 | CHRM2 (0.32) | — | |
| SCHEMBL5726347 | 0.67 | CHRM2 (0.32) | KDM4EMEN1NPC1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0812318-B1 | 4-AMINOTETRAHYDROBENZISOXAZOLE OR -ISOTHIAZOLE COMPOUNDS | LUNDBECK & CO AS H (DK) | 2006-02-08 | — | — | EP | disclosed |
| US-6174909-B1 | FOR TREATING ANALGESIA, PSYCHOSIS, CONVULSIONS, EPILEPSY, ANXIETY, MUSCULAR AND MOVEMENT DISORDERS, SPASTIC DISORDERS OR SYMPTOMS OF HUNTINGTON'S OR PARKINSONS DISEASE | H. LUNDBECK A/S (DK) | 2001-01-16 | — | — | US | disclosed |
| US-5998613-A | PSYCHOLOGICAL DISORDERS; ANALGESICS; ANTICONVULSANTS | H. LUNDBECK A/S (DK) | 1999-12-07 | — | — | US | disclosed |