Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 8/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 6/20 | 0.52 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | XBP1 | P17861 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | MT-CO2 | P00403 | 3/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CA3 | P07451 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12145728 | 0.81 | KDM4E (0.49) | MAPTALDH1A1NPSR1HSD17B10HTT | |
| SCHEMBL2277199 | 0.71 | PTGS2 (1.00) | PTGS2PTGS1MAPTNPSR1KMT2A | |
| SCHEMBL515631 | 0.70 | POLB (0.53) | MAPTALDH1A1NPSR1HSD17B10HTT | |
| SCHEMBL2985650 | 0.69 | PTGS2 (0.48) | PTGS2PTGS1MAPTALDH1A1NPSR1 | |
| SCHEMBL14349691 | 0.68 | SMN1; SMN2 (0.44) | MAPTALDH1A1HSD17B10KDM4ETSHR | |
| SCHEMBL10832137 | 0.66 | PTGS2 (0.58) | PTGS2PTGS1MAPTALDH1A1NPSR1 | |
| SCHEMBL7456757 | 0.66 | PTGS2 (0.50) | PTGS2PTGS1MAPTALDH1A1NPSR1 | |
| SCHEMBL25149515 | 0.66 | PTGS2 (0.86) | PTGS2PTGS1MAPTALDH1A1NPSR1 | |
| SCHEMBL1930084 | 0.65 | L3MBTL1 (0.67) | PTGS2PTGS1MAPTALDH1A1NPSR1 | |
| SCHEMBL6983193 | 0.65 | PTGS2 (0.67) | PTGS2PTGS1MAPTALDH1A1NPSR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2002081474-A1 | TRIAZOLOPHTHALAZINE / QUINOLINE / ISOQUINOLINE DERIVATIVES WHICH ARE LIGANDS FOR GABA-A RECEPTORS CONTAINING THE ALPHA 5 SUBTYPE | MERCK SHARP & DOHME LIMITED (GB) | 2002-10-17 | — | — | WO | disclosed |