Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | GAA | P10253 | 4/20 | 0.34 |
| ▸ | NPC1 | O15118 | 4/20 | 0.34 |
| ▸ | RAB9A | P51151 | 4/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.34 |
| ▸ | GLA | P06280 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 3/20 | 0.30 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5770463 | 0.84 | ALDH1A1 (0.36) | KDM4EALDH1A1GAANPC1RAB9A | |
| SCHEMBL5769993 | 0.81 | GABRA1 (0.39) | KDM4EALDH1A1GAANPC1RAB9A | |
| SCHEMBL5768555 | 0.81 | GABRA1 (0.33) | KDM4EALDH1A1GAANPC1RAB9A | |
| SCHEMBL6217363 | 0.79 | PLCG1 (0.38) | KDM4EALDH1A1GAANPC1RAB9A | |
| SCHEMBL6218809 | 0.77 | HMGCR (0.32) | NPC1RAB9AGABRA1GABRG2GABRB3 | |
| SCHEMBL5770695 | 0.77 | JAK2 (0.36) | — | |
| SCHEMBL7225919 | 0.73 | KDM4E (0.40) | KDM4EALDH1A1GAANPC1RAB9A | |
| SCHEMBL6102107 | 0.70 | ALDH1A1 (0.39) | KDM4EALDH1A1GAANPC1RAB9A | |
| SCHEMBL6217690 | 0.69 | HPGD (0.41) | KDM4EALDH1A1GAANPC1RAB9A | |
| SCHEMBL6222905 | 0.67 | KDM4E (0.43) | KDM4EALDH1A1GAANPC1RAB9A |
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 |