Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.41 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | SORD | Q00796 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL1681613 | 0.77 | PDE2A (0.40) | MAP2K1KDM5BKDM4EALDH1A1HPGD | |
| SCHEMBL1477241 | 0.76 | MAP2K1 (0.36) | MAP2K1 | |
| SCHEMBL5145554 | 0.72 | KDM4E (0.43) | KDM5BKDM4E | |
| SCHEMBL5983773 | 0.69 | KDM1A (0.44) | KDM5BKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL19194488 | 0.68 | TP53 (0.40) | KDM5BKDM4EALDH1A1HPGDNOS3 | |
| SCHEMBL19194489 | 0.67 | KDM5B (0.36) | KDM5BKDM4EHPGD | |
| SCHEMBL22503036 | 0.66 | ALDH1A1 (0.38) | KDM5BKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL19960596 | 0.66 | DPP4 (0.42) | MAP2K1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL19194473 | 0.66 | KDM4E (0.39) | KDM5BKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL7903223 | 0.65 | EGLN2 (0.41) | MAP2K1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0628559-B1 | Pyrimidine compounds and their use as pharmaceuticals | BEIERSDORF LILLY GMBH (DE) | 2002-04-03 | — | — | EP | disclosed |
| US-5602137-A | Pyrimidine compounds and their use as pharmaceuticals | BEIERSDORF-LILLY GMBH (DE) | 1997-02-11 | — | — | US | disclosed |
| US-5602136-A | Pyrimidine compounds and their use as pharmaceuticals | BEIERSDORF-LILLY GMBH (DE) | 1997-02-11 | — | — | US | disclosed |
| US-5571813-A | Fused pyrimidine compounds and their use as pharmaceuticals | BEIERSDORF-LILLY GMBH (DE) | 1996-11-05 | — | — | US | disclosed |
| EP-0628559-A1 | Pyrimidine compounds and their use as pharmaceuticals | Beiersdorf-Lilly GmbH (DE) | 1994-12-14 | — | — | EP | disclosed |