Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP3 | P08254 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 5/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.49 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7094090 | 0.95 | MTNR1A (0.53) | NPC1MAPK1HSD17B10USP2ALOX15 | |
| SCHEMBL17821174 | 0.90 | L3MBTL1 (0.54) | NPC1MAPK1HSD17B10USP2ALOX15 | |
| SCHEMBL25349904 | 0.86 | APP (0.51) | NPC1MAPK1HSD17B10USP2ALOX15 | |
| SCHEMBL25232048 | 0.85 | ALDH1A1 (0.49) | NPC1MAPK1HSD17B10USP2ALOX15 | |
| SCHEMBL15939818 | 0.83 | MTNR1A (0.53) | MMP3NPC1MAPK1HSD17B10USP2 | |
| SCHEMBL21099911 | 0.81 | MTNR1A (0.51) | MMP3NPC1MAPK1HSD17B10USP2 | |
| SCHEMBL10354336 | 0.80 | MTNR1A (0.73) | NPC1MAPK1HSD17B10USP2ALOX15 | |
| SCHEMBL23817033 | 0.80 | CA12 (0.67) | MMP3MTNR1AMTNR1B | |
| SCHEMBL21595955 | 0.80 | NPC1 (0.73) | NPC1MAPK1HSD17B10USP2ALOX15 | |
| SCHEMBL25268396 | 0.80 | DRD4 (0.57) | NPC1MAPK1HSD17B10USP2ALOX15 |
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-4103566-A1 | FUSED PYRIMIDINE COMPOUNDS AS KCC2 MODULATORS | AstraZeneca AB (SE) | 2022-12-21 | — | — | EP | disclosed |
| WO-2021180952-A1 | FUSED PYRIMIDINE COMPOUNDS AS KCC2 | ASTRAZENECA AB (SE) | 2021-09-16 | — | — | WO | disclosed |