Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.32 |
| ▸ | KDM5C | P41229 | 2/20 | 0.32 |
| ▸ | KDM5B | Q9UGL1 | 2/20 | 0.32 |
| ▸ | KDM4B | O94953 | 1/20 | 0.32 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.32 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.32 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.32 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | GLRA3 | O75311 | 1/20 | 0.31 |
| ▸ | GLRB | P48167 | 1/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CCNK | O75909 | 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 | |
|---|---|---|---|---|
| SCHEMBL6044654 | 0.77 | BACE1 (0.39) | KDM5CKDM5BCNR1KDM5A | |
| SCHEMBL6043432 | 0.74 | BACE1 (0.54) | — | |
| SCHEMBL3353364 | 0.74 | HCAR3 (0.48) | HCAR3S1PR1S1PR3KDM5CKDM5B | |
| Hydrochloric Acid SCHEMBL3855650 | 0.72 | HCAR3 (0.47) | HCAR3S1PR1S1PR3KDM5CKDM5B | |
| SCHEMBL2712687 | 0.70 | KDM5C (0.51) | KDM5CKDM5BKDM4BKDM4C | |
| SCHEMBL6608298 | 0.68 | KDM5A (0.41) | KDM5CKDM5BTLR7TLR8GLRA3 | |
| SCHEMBL3640416 | 0.67 | GLRA3 (0.50) | KDM5CKDM5BKDM4BPRKD1PRKD2 | |
| SCHEMBL3353484 | 0.64 | GLRA3 (0.45) | GLRA3GLRB | |
| SCHEMBL16199856 | 0.64 | HCAR3 (0.49) | HCAR3TSHRAOC3 | |
| SCHEMBL3352698 | 0.64 | HCAR3 (0.60) | HCAR3S1PR1S1PR3KDM5CKDM5B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1430032-A2 | SUBSTITUTED AMIDES FOR THE TREATMENT OF NEUROLOGICAL DISORDERS | Elan Pharmaceuticals, Inc. (US) | 2004-06-23 | — | — | EP | disclosed |
| WO-2003027068-A2 | SUBSTITUTED AMINES FOR THE TREATMENT OF NEUROLOGICAL DISORDERS | ELAN PHARMACEUTICALS, INC. (US) | 2003-04-03 | — | — | WO | disclosed |