Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.70 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.70 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.67 |
| ▸ | NPC1 | O15118 | 4/20 | 0.67 |
| ▸ | RAB9A | P51151 | 4/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.67 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.67 |
| ▸ | NPY1R | P25929 | 1/20 | 0.65 |
| ▸ | LTA4H | P09960 | 2/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.62 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.61 |
| ▸ | EGFR | P00533 | 1/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.59 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.59 |
| ▸ | HTR2A | P28223 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | SCN1A | P35498 | 1/20 | 0.59 |
| ▸ | HTR2B | P41595 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7371797 | 0.99 | HTT (0.68) | HTTKMT2AKDM4ENPC1RAB9A | |
| SCHEMBL1956688 | 0.90 | LTA4H (0.79) | HTTKMT2AKDM4ENPC1RAB9A | |
| SCHEMBL12128299 | 0.89 | ALDH1A1 (0.70) | HTTKDM4EALDH1A1NPSR1SMN1; SMN2 | |
| SCHEMBL7402238 | 0.87 | KDM4E (0.85) | HTTKMT2AKDM4ENPC1RAB9A | |
| SCHEMBL7399833 | 0.86 | KDM4E (0.85) | HTTKDM4ENPC1RAB9AALDH1A1 | |
| SCHEMBL7402377 | 0.86 | KDM4E (0.85) | HTTKDM4ENPC1RAB9AALDH1A1 | |
| SCHEMBL7400511 | 0.86 | KDM4E (0.85) | HTTKDM4ENPC1RAB9AALDH1A1 | |
| SCHEMBL7397895 | 0.86 | KDM4E (0.85) | HTTKDM4ENPC1RAB9AALDH1A1 | |
| Hydrochloric Acid SCHEMBL7397479 | 0.86 | KDM4E (0.82) | HTTKMT2AKDM4ENPC1RAB9A | |
| SCHEMBL7400512 | 0.86 | KDM4E (0.85) | HTTKDM4ENPC1RAB9AALDH1A1 |
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 | claimed |
| WO-1995011238-A1 | HETEROCYCLIC AMINES FOR TREATING ISCHAEMIC STROKES | SMITHKLINE BEECHAM PLC (GB) | 1995-04-27 | — | — | WO | claimed |
| 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 |