Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR5A1 | Q13285 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 2/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | SCN1A | P35498 | 1/20 | 0.39 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.39 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 10/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 10/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 10/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 10/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.38 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.38 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.38 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7392194 | 0.88 | MAOB (0.44) | LTA4HSCN1ASCN2ASCN3A | |
| Hydrochloric Acid SCHEMBL7403380 | 0.87 | MAOB (0.43) | LTA4HSCN1ASCN2ASCN3A | |
| SCHEMBL7403861 | 0.87 | KMT2A (0.44) | LTA4HSCN1ASCN2ASCN3AS1PR1 | |
| SCHEMBL7398553 | 0.87 | KCNH2 (0.43) | LTA4HSCN1ASCN2ASCN3A | |
| Hydrochloric Acid SCHEMBL7397296 | 0.86 | KMT2A (0.43) | LTA4HSCN1ASCN2ASCN3A | |
| Hydrochloric Acid SCHEMBL7398909 | 0.86 | KCNH2 (0.42) | LTA4HSCN1ASCN2ASCN3A | |
| SCHEMBL7490525 | 0.85 | HRH3 (0.47) | LTA4H | |
| SCHEMBL7402551 | 0.85 | LTA4H (0.43) | LTA4H | |
| SCHEMBL7398807 | 0.85 | LTA4H (0.43) | LTA4H | |
| Hydrochloric Acid SCHEMBL7400725 | 0.84 | MEN1 (0.43) | LTA4H |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0724577-A1 | HETEROCYCLIC AMINES FOR TREATING ISCHAEMIC STROKES | SMITHKLINE BEECHAM PLC (GB) | 1996-08-07 | — | — | EP | disclosed |
| WO-1995011238-A1 | HETEROCYCLIC AMINES FOR TREATING ISCHAEMIC STROKES | SMITHKLINE BEECHAM PLC (GB) | 1995-04-27 | — | — | WO | disclosed |
| EP-0637303-A1 | N-ARYLOXY(THIO)ALKYL-AZACYCLOALKANES USEFUL AS CALCIUM CHANNEL ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1995-02-08 | — | — | EP | disclosed |
| WO-1993022302-A1 | N-ARYLOXY(THIO)ALKYL-AZACYCLOALKANES USEFUL AS CALCIUM CHANNEL ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1993-11-11 | — | — | WO | disclosed |