Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | GSK3A | P49840 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | AHR | P35869 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7745186 | 0.88 | CYP1A2 (0.42) | CYP1A2BACE1L3MBTL1MAPTALDH1A1 | |
| SCHEMBL7744728 | 0.86 | MAPT (0.44) | CYP1A2BACE1L3MBTL1MAPTALDH1A1 | |
| SCHEMBL6854551 | 0.74 | L3MBTL1 (0.65) | L3MBTL1MAPTALDH1A1KDM4EKMT2A | |
| SCHEMBL1088580 | 0.73 | CYP1A2 (0.69) | CYP1A2BACE1L3MBTL1MAPTALDH1A1 | |
| SCHEMBL3499056 | 0.72 | ACP1 (0.58) | CYP1A2BACE1MAPTALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL4384053 | 0.69 | CYP1A2 (0.64) | CYP1A2BACE1L3MBTL1MAPTALDH1A1 | |
| Iodide SCHEMBL4544205 | 0.69 | CYP1A2 (0.64) | CYP1A2BACE1L3MBTL1MAPTALDH1A1 | |
| Bromide SCHEMBL4396731 | 0.69 | CYP1A2 (0.64) | CYP1A2BACE1L3MBTL1MAPTALDH1A1 | |
| SCHEMBL423741 | 0.69 | CYP1A2 (0.58) | CYP1A2BACE1L3MBTL1MAPTALDH1A1 | |
| SCHEMBL31473229 | 0.69 | CYP1A2 (0.58) | CYP1A2BACE1L3MBTL1MAPTALDH1A1 |
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-2001002385-A1 | 1-(QUINOLIN-4-YL)-1H-PYRAZOLE DERIVATIVES AND THEIR USE AS FUNGICIDES | AVENTIS CROPSCIENCE S.A. (FR) | 2001-01-11 | — | — | WO | claimed |