Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 11/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 7/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5772646 | 0.81 | NPC1 (0.38) | ALDH1A1KDM4EPKMHPGDNPC1 | |
| Hydrochloric Acid SCHEMBL5772800 | 0.79 | NPC1 (0.37) | ALDH1A1KDM4EPKMHPGDNPC1 | |
| SCHEMBL19817523 | 0.77 | ALDH1A1 (0.35) | ALDH1A1KDM4EPKMHPGDNPC1 | |
| SCHEMBL6217690 | 0.77 | HPGD (0.41) | ALDH1A1KDM4EPKMHPGDNPC1 | |
| SCHEMBL2053853 | 0.74 | KCNH2 (0.47) | ALDH1A1KDM4EPKMHPGDNPC1 | |
| SCHEMBL9597409 | 0.72 | KDM4E (0.58) | ALDH1A1KDM4EPKMHPGDNPC1 | |
| SCHEMBL5771083 | 0.71 | CYP19A1 (0.41) | ALDH1A1KDM4EHPGDSMN1; SMN2MAPT | |
| SCHEMBL6218809 | 0.70 | HMGCR (0.32) | NPC1RAB9ADYRK1A | |
| SCHEMBL2666326 | 0.69 | DYRK1A (0.35) | ALDH1A1KDM4EHPGDNPC1RAB9A | |
| SCHEMBL5808966 | 0.69 | RAB9A (0.39) | ALDH1A1KDM4EHPGDNPC1RAB9A |
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-1383768-B1 | IMIDAZO-PYRIMIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME (GB) | 2006-09-06 | — | — | EP | disclosed |
| EP-1381606-B1 | IMIDAZO-PYRIMIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME (GB) | 2005-07-20 | — | — | EP | disclosed |
| US-6642229-B2 | Treatment of adverse neurological conditions | MERCK SHARP & DOHME LTD. | 2003-11-04 | — | — | US | disclosed |