Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.47 |
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | MAT2A | P31153 | 1/20 | 0.46 |
| ▸ | FABP4 | P15090 | 3/20 | 0.44 |
| ▸ | FABP5 | Q01469 | 2/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | USP2 | O75604 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9541577 | 0.95 | KDM4E (0.45) | KDM4ELMNAHTTL3MBTL1MAT2A | |
| SCHEMBL9540062 | 0.78 | KDM4E (0.51) | KDM4ELMNAHTTL3MBTL1MAT2A | |
| SCHEMBL9539113 | 0.75 | KDM4E (0.48) | KDM4ELMNAHTTL3MBTL1MAT2A | |
| SCHEMBL9540153 | 0.75 | KDM4E (0.50) | KDM4ELMNAHTTL3MBTL1MAT2A | |
| SCHEMBL11635515 | 0.73 | MAPT (0.47) | KDM4ELMNAHTTMAT2AMAPT | |
| SCHEMBL9539742 | 0.68 | AURKA (0.52) | KDM4ELMNAHTTL3MBTL1MAPT | |
| SCHEMBL26705536 | 0.68 | MAT2A (0.43) | KDM4ELMNAHTTL3MBTL1MAT2A | |
| SCHEMBL9539747 | 0.67 | KDM4E (0.47) | KDM4ELMNAHTTL3MBTL1MAT2A | |
| SCHEMBL31268550 | 0.66 | LMNA (0.46) | KDM4ELMNAHTTL3MBTL1MAT2A | |
| SCHEMBL25373152 | 0.66 | MAPK8 (0.53) | FABP4FABP5 |
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-0530994-A1 | Quinazoline derivatives as inhibitors of HIV reverse transcriptase | MERCK & CO. INC. (US) | 1993-03-10 | — | — | EP | disclosed |
| WO-1993004047-A1 | QUINAZOLINE DERIVATIVES AS INHIBITORS OF HIV REVERSE TRANSCRIPTASE | MERCK & CO., INC. (US) | 1993-03-04 | — | — | WO | disclosed |